Product OPENEYE NAME: N-[2-[7-[(3,4-dichlorophenyl)methylamino]-3-oxo-2-(3-pyridyl)pyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
CAS Name: N-[2-[7-[(3,4-dichlorophenyl)methylamino]-3-oxo-2-(3-pyridinyl)-4-pyrido[2,3-b]pyrazinyl]ethyl]acetamide
IUPAC NAME: N-[2-[7-[(3,4-dichlorophenyl)methylamino]-3-oxo-2-pyridin-3-ylpyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
SYSTEMATIC NAME: N-[2-[7-[(3,4-dichlorophenyl)methylamino]-3-oxidanylidene-2-pyridin-3-yl-pyrido[2,3-b]pyrazin-4-yl]ethyl]ethanamide
MOLECULAR FORMULA: C23H20Cl2N6O2
MOLECULAR WEIGHT: 483.3499
SMILES: CC(=O)NCCN1C2=NC=C(C=C2N=C(C1=O)C3=CN=CC=C3)NCC4=CC(=C(C=C4)Cl)Cl
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Product OPENEYE NAME: N-[2-[7-(benzylamino)-2-methyl-3-oxo-pyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
CAS Name: N-[2-[2-methyl-3-oxo-7-[(phenylmethyl)amino]-4-pyrido[2,3-b]pyrazinyl]ethyl]acetamide
IUPAC NAME: N-[2-[7-(benzylamino)-2-methyl-3-oxopyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
SYSTEMATIC NAME: N-[2-[2-methyl-3-oxidanylidene-7-[(phenylmethyl)amino]pyrido[2,3-b]pyrazin-4-yl]ethyl]ethanamide
MOLECULAR FORMULA: C19H21N5O2
MOLECULAR WEIGHT: 351.40234
SMILES: CC1=NC2=CC(=CN=C2N(C1=O)CCNC(=O)C)NCC3=CC=CC=C3
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Product OPENEYE NAME: benzyl N-[4-(2-acetamidoethyl)-2-methyl-3-oxo-1,2-dihydropyrido[2,3-b]pyrazin-7-yl]carbamate
CAS Name: N-[4-(2-acetamidoethyl)-2-methyl-3-oxo-1,2-dihydropyrido[2,3-b]pyrazin-7-yl]carbamic acid (phenylmethyl) ester
IUPAC NAME: benzyl N-[4-(2-acetamidoethyl)-2-methyl-3-oxo-1,2-dihydropyrido[2,3-b]pyrazin-7-yl]carbamate
SYSTEMATIC NAME: (phenylmethyl) N-[4-(2-acetamidoethyl)-2-methyl-3-oxidanylidene-1,2-dihydropyrido[2,3-b]pyrazin-7-yl]carbamate
MOLECULAR FORMULA: C20H23N5O4
MOLECULAR WEIGHT: 397.42772
SMILES: CC1C(=O)N(C2=NC=C(C=C2N1)NC(=O)OCC3=CC=CC=C3)CCNC(=O)C
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Product OPENEYE NAME: 3-hydroxy-N-[2-[3-methyl-2-oxo-7-[[3-(trifluoromethyl)phenyl]methylamino]quinoxalin-1-yl]ethyl]propanamide
CAS Name: 3-hydroxy-N-[2-[3-methyl-2-oxo-7-[[3-(trifluoromethyl)phenyl]methylamino]-1-quinoxalinyl]ethyl]propanamide
IUPAC NAME: 3-hydroxy-N-[2-[3-methyl-2-oxo-7-[[3-(trifluoromethyl)phenyl]methylamino]quinoxalin-1-yl]ethyl]propanamide
SYSTEMATIC NAME: N-[2-[3-methyl-2-oxidanylidene-7-[[3-(trifluoromethyl)phenyl]methylamino]quinoxalin-1-yl]ethyl]-3-oxidanyl-propanamide
MOLECULAR FORMULA: C22H23F3N4O3
MOLECULAR WEIGHT: 448.43823
SMILES: CC1=NC2=C(C=C(C=C2)NCC3=CC(=CC=C3)C(F)(F)F)N(C1=O)CCNC(=O)CCO
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Product OPENEYE NAME: N-(2-hydroxyethyl)-3-[3-methyl-2-oxo-7-[[3-(trifluoromethyl)phenyl]methylamino]quinoxalin-1-yl]propanamide
CAS Name: N-(2-hydroxyethyl)-3-[3-methyl-2-oxo-7-[[3-(trifluoromethyl)phenyl]methylamino]-1-quinoxalinyl]propanamide
IUPAC NAME: N-(2-hydroxyethyl)-3-[3-methyl-2-oxo-7-[[3-(trifluoromethyl)phenyl]methylamino]quinoxalin-1-yl]propanamide
SYSTEMATIC NAME: N-(2-hydroxyethyl)-3-[3-methyl-2-oxidanylidene-7-[[3-(trifluoromethyl)phenyl]methylamino]quinoxalin-1-yl]propanamide
MOLECULAR FORMULA: C22H23F3N4O3
MOLECULAR WEIGHT: 448.43823
SMILES: CC1=NC2=C(C=C(C=C2)NCC3=CC(=CC=C3)C(F)(F)F)N(C1=O)CCC(=O)NCCO
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Product OPENEYE NAME: N-(cyclohexylmethyl)-2-(6-fluoro-1H-indol-3-yl)-2-oxo-N-(2-pyridylmethyl)acetamide
CAS Name: N-(cyclohexylmethyl)-2-(6-fluoro-1H-indol-3-yl)-2-oxo-N-(2-pyridinylmethyl)acetamide
IUPAC NAME: N-(cyclohexylmethyl)-2-(6-fluoro-1H-indol-3-yl)-2-oxo-N-(pyridin-2-ylmethyl)acetamide
SYSTEMATIC NAME: N-(cyclohexylmethyl)-2-(6-fluoranyl-1H-indol-3-yl)-2-oxidanylidene-N-(pyridin-2-ylmethyl)ethanamide
MOLECULAR FORMULA: C23H24FN3O2
MOLECULAR WEIGHT: 393.453963
SMILES: C1CCC(CC1)CN(CC2=CC=CC=N2)C(=O)C(=O)C3=CNC4=C3C=CC(=C4)F
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Product OPENEYE NAME: N-(cyclohexylmethyl)-2-(6-fluoro-1H-indol-3-yl)-2-oxo-N-(3-pyridylmethyl)acetamide
CAS Name: N-(cyclohexylmethyl)-2-(6-fluoro-1H-indol-3-yl)-2-oxo-N-(3-pyridinylmethyl)acetamide
IUPAC NAME: N-(cyclohexylmethyl)-2-(6-fluoro-1H-indol-3-yl)-2-oxo-N-(pyridin-3-ylmethyl)acetamide
SYSTEMATIC NAME: N-(cyclohexylmethyl)-2-(6-fluoranyl-1H-indol-3-yl)-2-oxidanylidene-N-(pyridin-3-ylmethyl)ethanamide
MOLECULAR FORMULA: C23H24FN3O2
MOLECULAR WEIGHT: 393.453963
SMILES: C1CCC(CC1)CN(CC2=CN=CC=C2)C(=O)C(=O)C3=CNC4=C3C=CC(=C4)F
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Product OPENEYE NAME: N-(cyclohexylmethyl)-2-(6-fluoro-1H-indol-3-yl)-2-oxo-N-(4-pyridylmethyl)acetamide
CAS Name: N-(cyclohexylmethyl)-2-(6-fluoro-1H-indol-3-yl)-2-oxo-N-(pyridin-4-ylmethyl)acetamide
IUPAC NAME: N-(cyclohexylmethyl)-2-(6-fluoro-1H-indol-3-yl)-2-oxo-N-(pyridin-4-ylmethyl)acetamide
SYSTEMATIC NAME: N-(cyclohexylmethyl)-2-(6-fluoranyl-1H-indol-3-yl)-2-oxidanylidene-N-(pyridin-4-ylmethyl)ethanamide
MOLECULAR FORMULA: C23H24FN3O2
MOLECULAR WEIGHT: 393.453963
SMILES: C1CCC(CC1)CN(CC2=CC=NC=C2)C(=O)C(=O)C3=CNC4=C3C=CC(=C4)F
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Product OPENEYE NAME: [1-[[3-[(tert-butoxycarbonylamino)methyl]phenyl]methyl-[2-(1H-indol-3-yl)-2-oxo-acetyl]amino]cyclohexyl] acetate
CAS Name: acetic acid [1-[[2-(1H-indol-3-yl)-1,2-dioxoethyl]-[[3-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]phenyl]methyl]amino]cyclohexyl] ester
IUPAC NAME: [1-[[2-(1H-indol-3-yl)-2-oxoacetyl]-[[3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]methyl]amino]cyclohexyl] acetate
SYSTEMATIC NAME: [1-[[2-(1H-indol-3-yl)-2-oxidanylidene-ethanoyl]-[[3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]methyl]amino]cyclohexyl] ethanoate
MOLECULAR FORMULA: C31H37N3O6
MOLECULAR WEIGHT: 547.64198
SMILES: CC(=O)OC1(CCCCC1)N(CC2=CC=CC(=C2)CNC(=O)OC(C)(C)C)C(=O)C(=O)C3=CNC4=CC=CC=C43
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Product OPENEYE NAME: tert-butyl N-[[3-[[[2-(tert-butylamino)-1-methyl-2-oxo-ethyl]-[2-(1H-indol-3-yl)-2-oxo-acetyl]amino]methyl]phenyl]methyl]carbamate
CAS Name: N-[[3-[[[1-(tert-butylamino)-1-oxopropan-2-yl]-[2-(1H-indol-3-yl)-1,2-dioxoethyl]amino]methyl]phenyl]methyl]carbamic acid tert-butyl ester
IUPAC NAME: tert-butyl N-[[3-[[[1-(tert-butylamino)-1-oxopropan-2-yl]-[2-(1H-indol-3-yl)-2-oxoacetyl]amino]methyl]phenyl]methyl]carbamate
SYSTEMATIC NAME: tert-butyl N-[[3-[[[1-(tert-butylamino)-1-oxidanylidene-propan-2-yl]-[2-(1H-indol-3-yl)-2-oxidanylidene-ethanoyl]amino]methyl]phenyl]methyl]carbamate
MOLECULAR FORMULA: C30H38N4O5
MOLECULAR WEIGHT: 534.64652
SMILES: CC(C(=O)NC(C)(C)C)N(CC1=CC=CC(=C1)CNC(=O)OC(C)(C)C)C(=O)C(=O)C2=CNC3=CC=CC=C32
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Product OPENEYE NAME: tert-butyl 4-[2-[cyclohexylmethyl-[2-(1H-indol-3-yl)-2-oxo-acetyl]amino]ethyl]piperazine-1-carboxylate
CAS Name: 4-[2-[cyclohexylmethyl-[2-(1H-indol-3-yl)-1,2-dioxoethyl]amino]ethyl]-1-piperazinecarboxylic acid tert-butyl ester
IUPAC NAME: tert-butyl 4-[2-[cyclohexylmethyl-[2-(1H-indol-3-yl)-2-oxoacetyl]amino]ethyl]piperazine-1-carboxylate
SYSTEMATIC NAME: tert-butyl 4-[2-[cyclohexylmethyl-[2-(1H-indol-3-yl)-2-oxidanylidene-ethanoyl]amino]ethyl]piperazine-1-carboxylate
MOLECULAR FORMULA: C28H40N4O4
MOLECULAR WEIGHT: 496.6416
SMILES: CC(C)(C)OC(=O)N1CCN(CC1)CCN(CC2CCCCC2)C(=O)C(=O)C3=CNC4=CC=CC=C43
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Product OPENEYE NAME: 2-[(3R)-6-[3-(3-aminopropoxy)phenoxy]-1-hydroxy-3H-2,1-benzoxaborol-3-yl]acetic acid
CAS Name: 2-[(3R)-6-[3-(3-aminopropoxy)phenoxy]-1-hydroxy-3H-2,1-benzoxaborol-3-yl]acetic acid
IUPAC NAME: 2-[(3R)-6-[3-(3-aminopropoxy)phenoxy]-1-hydroxy-3H-2,1-benzoxaborol-3-yl]acetic acid
SYSTEMATIC NAME: 2-[(3R)-6-[3-(3-azanylpropoxy)phenoxy]-1-oxidanyl-3H-2,1-benzoxaborol-3-yl]ethanoic acid
MOLECULAR FORMULA: C18H20BNO6
MOLECULAR WEIGHT: 357.1655
SMILES: B1(C2=C(C=CC(=C2)OC3=CC(=CC=C3)OCCCN)[C@H](O1)CC(=O)O)O
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C41H42ClF3N6O8S2
MOLECULAR WEIGHT: 903.38579
SMILES: COC1=CN=C(C2=C1C=CC(=C2)Cl)O[C@@H]3C[C@H]4C(=O)N[C@@]5(C[C@H]5/C=C\CCCCC[C@@H](C(=O)N4C3)NC6=NC(=CS6)C7=CC=C(C=C7)OC(F)(F)F)C(=O)NS(=O)(=O)C8CC8
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Product OPENEYE NAME: N-[4-(3-amino-1-piperidyl)-5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide
CAS Name: N-[4-(3-amino-1-piperidinyl)-5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl]-3-pyridinecarboxamide
IUPAC NAME: N-[4-(3-aminopiperidin-1-yl)-5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide
SYSTEMATIC NAME: N-[4-(3-azanylpiperidin-1-yl)-5-bromanyl-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide
MOLECULAR FORMULA: C18H19BrN6O
MOLECULAR WEIGHT: 415.28706
SMILES: C1CC(CN(C1)C2=C3C(=CNC3=NC=C2Br)NC(=O)C4=CN=CC=C4)N
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Product OPENEYE NAME: 3-[8-amino-1-[4-(1-hydroxy-1-phenyl-ethyl)phenyl]imidazo[1,5-a]pyrazin-3-yl]-1-methyl-cyclobutanol
CAS Name: 3-[8-amino-1-[4-(1-hydroxy-1-phenylethyl)phenyl]-3-imidazo[1,5-a]pyrazinyl]-1-methyl-1-cyclobutanol
IUPAC NAME: 3-[8-amino-1-[4-(1-hydroxy-1-phenylethyl)phenyl]imidazo[1,5-a]pyrazin-3-yl]-1-methylcyclobutan-1-ol
SYSTEMATIC NAME: 3-[8-azanyl-1-[4-(1-oxidanyl-1-phenyl-ethyl)phenyl]imidazo[1,5-a]pyrazin-3-yl]-1-methyl-cyclobutan-1-ol
MOLECULAR FORMULA: C25H26N4O2
MOLECULAR WEIGHT: 414.49954
SMILES: CC1(CC(C1)C2=NC(=C3N2C=CN=C3N)C4=CC=C(C=C4)C(C)(C5=CC=CC=C5)O)O
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Product OPENEYE NAME: 2-[(4E)-4-[[5-(4-chlorophenyl)-2-thienyl]methylene]-5-oxo-2-thioxo-imidazolidin-1-yl]-3-phenyl-propanoic acid
CAS Name: 2-[(4E)-4-[[5-(4-chlorophenyl)-2-thiophenyl]methylidene]-5-oxo-2-sulfanylidene-1-imidazolidinyl]-3-phenylpropanoic acid
IUPAC NAME: 2-[(4E)-4-[[5-(4-chlorophenyl)thiophen-2-yl]methylidene]-5-oxo-2-sulfanylideneimidazolidin-1-yl]-3-phenylpropanoic acid
SYSTEMATIC NAME: 2-[(4E)-4-[[5-(4-chlorophenyl)thiophen-2-yl]methylidene]-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]-3-phenyl-propanoic acid
MOLECULAR FORMULA: C23H17ClN2O3S2
MOLECULAR WEIGHT: 468.97568
SMILES: C1=CC=C(C=C1)CC(C(=O)O)N2C(=O)/C(=C\C3=CC=C(S3)C4=CC=C(C=C4)Cl)/NC2=S
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Product OPENEYE NAME: 2-[[4-[2-[[2-[3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-4-yl]oxyacetyl]amino]butanoylamino]-5-amino-5-oxo-pentanoyl]amino]-6-(octadecanoylamino)hexanoic acid
CAS Name: 2-[[4-[[2-[[2-[[3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)-4-oxanyl]oxy]-1-oxoethyl]amino]-1-oxobutyl]amino]-5-amino-1,5-dioxopentyl]amino]-6-(1-oxooctadecylamino)hexanoic acid
IUPAC NAME: 2-[[4-[2-[[2-[3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxyacetyl]amino]butanoylamino]-5-amino-5-oxopentanoyl]amino]-6-(octadecanoylamino)hexanoic acid
SYSTEMATIC NAME: 2-[[4-[2-[2-[5-acetamido-2-(hydroxymethyl)-3,6-bis(oxidanyl)oxan-4-yl]oxyethanoylamino]butanoylamino]-5-azanyl-5-oxidanylidene-pentanoyl]amino]-6-(octadecanoylamino)hexanoic acid
MOLECULAR FORMULA: C43H78N6O13
MOLECULAR WEIGHT: 887.11182
SMILES: CCCCCCCCCCCCCCCCCC(=O)NCCCCC(C(=O)O)NC(=O)CCC(C(=O)N)NC(=O)C(CC)NC(=O)COC1C(C(OC(C1O)CO)O)NC(=O)C
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Product OPENEYE NAME: 2-[[4-[2-[[2-[3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-4-yl]oxyacetyl]amino]butanoylamino]-5-amino-5-oxo-pentanoyl]amino]-6-(2-tridecylpentadecanoylamino)hexanoic acid
CAS Name: 2-[[4-[[2-[[2-[[3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)-4-oxanyl]oxy]-1-oxoethyl]amino]-1-oxobutyl]amino]-5-amino-1,5-dioxopentyl]amino]-6-[(1-oxo-2-tridecylpentadecyl)amino]hexanoic acid
IUPAC NAME: 2-[[4-[2-[[2-[3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxyacetyl]amino]butanoylamino]-5-amino-5-oxopentanoyl]amino]-6-(2-tridecylpentadecanoylamino)hexanoic acid
SYSTEMATIC NAME: 2-[[4-[2-[2-[5-acetamido-2-(hydroxymethyl)-3,6-bis(oxidanyl)oxan-4-yl]oxyethanoylamino]butanoylamino]-5-azanyl-5-oxidanylidene-pentanoyl]amino]-6-(2-tridecylpentadecanoylamino)hexanoic acid
MOLECULAR FORMULA: C53H98N6O13
MOLECULAR WEIGHT: 1027.37762
SMILES: CCCCCCCCCCCCCC(CCCCCCCCCCCCC)C(=O)NCCCCC(C(=O)O)NC(=O)CCC(C(=O)N)NC(=O)C(CC)NC(=O)COC1C(C(OC(C1O)CO)O)NC(=O)C
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Product OPENEYE NAME: 2-[[4-[2-[[2-[3-acetamido-5-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-2-hydroxy-6-(hydroxymethyl)tetrahydropyran-4-yl]oxyacetyl]amino]butanoylamino]-5-amino-5-oxo-pentanoyl]amino]-6-(2-tridecylpentadecanoylamino)hexanoic acid
CAS Name: 2-[[4-[[2-[[2-[[3-acetamido-5-[[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-hydroxy-6-(hydroxymethyl)-4-oxanyl]oxy]-1-oxoethyl]amino]-1-oxobutyl]amino]-5-amino-1,5-dioxopentyl]amino]-6-[(1-oxo-2-tridecylpentadecyl)amino]hexanoic acid
IUPAC NAME: 2-[[4-[2-[[2-[3-acetamido-5-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxyacetyl]amino]butanoylamino]-5-amino-5-oxopentanoyl]amino]-6-(2-tridecylpentadecanoylamino)hexanoic acid
SYSTEMATIC NAME: 2-[[4-[2-[2-[5-acetamido-3-[3-acetamido-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]oxy-2-(hydroxymethyl)-6-oxidanyl-oxan-4-yl]oxyethanoylamino]butanoylamino]-5-azanyl-5-oxidanylidene-pentanoyl]amino]-6-(2-tridecylpentadecanoylamino)hexanoic acid
MOLECULAR FORMULA: C61H111N7O18
MOLECULAR WEIGHT: 1230.57014
SMILES: CCCCCCCCCCCCCC(CCCCCCCCCCCCC)C(=O)NCCCCC(C(=O)O)NC(=O)CCC(C(=O)N)NC(=O)C(CC)NC(=O)COC1C(C(OC(C1OC2C(C(C(C(O2)CO)O)O)NC(=O)C)CO)O)NC(=O)C
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Product OPENEYE NAME: 1-cyclopropyl-8-(difluoromethoxy)-7-[(1R)-1-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl]-4-oxo-quinoline-3-carboxylic acid
CAS Name: 1-cyclopropyl-8-(difluoromethoxy)-7-[(1R)-1-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl]-4-oxo-3-quinolinecarboxylic acid
IUPAC NAME: 1-cyclopropyl-8-(difluoromethoxy)-7-[(1R)-1-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl]-4-oxoquinoline-3-carboxylic acid
SYSTEMATIC NAME: 8-[bis(fluoranyl)methoxy]-1-cyclopropyl-7-[(1R)-1-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl]-4-oxidanylidene-quinoline-3-carboxylic acid
MOLECULAR FORMULA: C22H21F2N3O4
MOLECULAR WEIGHT: 429.416646
SMILES: C[C@@H]1C2=CC(=CN2CCN1)C3=C(C4=C(C=C3)C(=O)C(=CN4C5CC5)C(=O)O)OC(F)F
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