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MOLECULAR FORMULA: C34H39N5O6S2
MOLECULAR WEIGHT: 677.83336
SMILES: C1CC/C=C\[C@@H]2C[C@]2(NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](CC1)NC4=CC=CC=C4)OC5=NC6=CC=CC=C6S5)C(=O)NS(=O)(=O)C7CC7
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MOLECULAR FORMULA: C34H38BrN5O6S2
MOLECULAR WEIGHT: 756.72942
SMILES: C1CC/C=C\[C@@H]2C[C@]2(NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](CC1)NC4=CC=CC=C4)OC5=NC6=C(S5)C=C(C=C6)Br)C(=O)NS(=O)(=O)C7CC7
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MOLECULAR FORMULA: C35H41N5O7S2
MOLECULAR WEIGHT: 707.85934
SMILES: COC1=CC2=C(C=C1)N=C(S2)O[C@@H]3C[C@H]4C(=O)N[C@@]5(C[C@H]5/C=C\CCCCC[C@@H](C(=O)N4C3)NC6=CC=CC=C6)C(=O)NS(=O)(=O)C7CC7
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MOLECULAR FORMULA: C34H38FN5O6S2
MOLECULAR WEIGHT: 695.823823
SMILES: C1CC/C=C\[C@@H]2C[C@]2(NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](CC1)NC4=CC=CC=C4)OC5=NC6=C(S5)C=C(C=C6)F)C(=O)NS(=O)(=O)C7CC7
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Product OPENEYE NAME: (3aS,6S,6aS,9aS,9bR)-6a-hydroxy-3-(imidazol-1-ylmethyl)-6,9a-dimethyl-3,3a,4,5,6,9b-hexahydroazuleno[8,7-b]furan-2,9-dione
CAS Name: (3aS,6S,6aS,9aS,9bR)-6a-hydroxy-3-(1-imidazolylmethyl)-6,9a-dimethyl-3,3a,4,5,6,9b-hexahydroazuleno[8,7-b]furan-2,9-dione
IUPAC NAME: (3aS,6S,6aS,9aS,9bR)-6a-hydroxy-3-(imidazol-1-ylmethyl)-6,9a-dimethyl-3,3a,4,5,6,9b-hexahydroazuleno[8,7-b]furan-2,9-dione
SYSTEMATIC NAME: (3aS,6S,6aS,9aS,9bR)-3-(imidazol-1-ylmethyl)-6,9a-dimethyl-6a-oxidanyl-3,3a,4,5,6,9b-hexahydroazuleno[8,7-b]furan-2,9-dione
MOLECULAR FORMULA: C18H22N2O4
MOLECULAR WEIGHT: 330.37828
SMILES: C[C@H]1CC[C@@H]2[C@H]([C@]3([C@]1(C=CC3=O)O)C)OC(=O)C2CN4C=CN=C4
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Product OPENEYE NAME: (3aS,6S,6aR,9aS,9bR)-6a,9-dihydroxy-3,6,9a-trimethyl-3a,4,5,6,7,8,9,9b-octahydro-3H-azuleno[4,5-b]furan-2-one
CAS Name: (3aS,6S,6aR,9aS,9bR)-6a,9-dihydroxy-3,6,9a-trimethyl-3a,4,5,6,7,8,9,9b-octahydro-3H-azuleno[4,5-b]furan-2-one
IUPAC NAME: (3aS,6S,6aR,9aS,9bR)-6a,9-dihydroxy-3,6,9a-trimethyl-3a,4,5,6,7,8,9,9b-octahydro-3H-azuleno[4,5-b]furan-2-one
SYSTEMATIC NAME: (3aS,6S,6aR,9aS,9bR)-3,6,9a-trimethyl-6a,9-bis(oxidanyl)-3a,4,5,6,7,8,9,9b-octahydro-3H-azuleno[4,5-b]furan-2-one
MOLECULAR FORMULA: C15H24O4
MOLECULAR WEIGHT: 268.34866
SMILES: C[C@H]1CC[C@@H]2[C@H]([C@]3([C@]1(CCC3O)O)C)OC(=O)C2C
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Product OPENEYE NAME: (2R)-2-[[(2S,3S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]-5-oxo-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-hydroxy-propanoyl]pyrrolidine-2-carbonyl]amino]-3-methyl-pentanoyl]amino]-3-sulfanyl-propanoic acid
CAS Name: (2R)-2-[[(2S,3S)-2-[[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-1-oxo-3-phenylpropyl]amino]-1,5-dioxopentyl]amino]-4-methyl-1-oxopentyl]amino]-3-hydroxy-1-oxopropyl]-2-pyrrolidinyl]-oxomethyl]amino]-3-methyl-1-oxopentyl]amino]-3-mercaptoprop
IUPAC NAME: (2R)-2-[[(2S,3S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-5-oxopentanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoyl]amino]-3-sulfanylpropanoic acid
SYSTEMATIC NAME: (2R)-2-[[(2S,3S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-5-azanyl-2-[[(2S)-2-azanyl-3-phenyl-propanoyl]amino]-5-oxidanylidene-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-oxidanyl-propanoyl]pyrrolidin-2-yl]carbonylamino]-3-methyl-pentanoyl]amino]-3-sulfanyl-pr
MOLECULAR FORMULA: C37H58N8O10S
MOLECULAR WEIGHT: 806.96902
SMILES: CC[C@H](C)[C@@H](C(=O)N[C@@H](CS)C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC2=CC=CC=C2)N
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Product OPENEYE NAME: (2S,3S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-amino-3-carboxy-propanoyl]amino]-3-phenyl-propanoyl]amino]-5-oxo-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-hydroxy-propanoyl]pyrrolidine-2-carbonyl]amino]-3-methyl-pentanoic acid
CAS Name: (2S,3S)-2-[[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-amino-3-carboxy-1-oxopropyl]amino]-1-oxo-3-phenylpropyl]amino]-1,5-dioxopentyl]amino]-4-methyl-1-oxopentyl]amino]-3-hydroxy-1-oxopropyl]-2-pyrrolidinyl]-oxomethyl]amino]-3-methylpenta
IUPAC NAME: (2S,3S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-amino-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-5-oxopentanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoic acid
SYSTEMATIC NAME: (2S,3S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-5-azanyl-2-[[(2S)-2-[[(2S)-2-azanyl-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-3-phenyl-propanoyl]amino]-5-oxidanylidene-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-oxidanyl-propanoyl]pyrrolidin-2-yl]carbonylami
MOLECULAR FORMULA: C38H58N8O12
MOLECULAR WEIGHT: 818.91352
SMILES: CC[C@H](C)[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CC(=O)O)N
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Product OPENEYE NAME: 1-(4-fluorophenyl)-N-[[4-(tetrahydropyran-4-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide
CAS Name: 1-(4-fluorophenyl)-N-[[4-(4-oxanylsulfamoyl)phenyl]methyl]-4-indazolecarboxamide
IUPAC NAME: 1-(4-fluorophenyl)-N-[[4-(oxan-4-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide
SYSTEMATIC NAME: 1-(4-fluorophenyl)-N-[[4-(oxan-4-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide
MOLECULAR FORMULA: C26H25FN4O4S
MOLECULAR WEIGHT: 508.564503
SMILES: C1COCCC1NS(=O)(=O)C2=CC=C(C=C2)CNC(=O)C3=C4C=NN(C4=CC=C3)C5=CC=C(C=C5)F
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Product OPENEYE NAME: ethyl 5-[[[1-(4-fluorophenyl)indazole-4-carbonyl]amino]methyl]pyridine-3-carboxylate
CAS Name: 5-[[[[1-(4-fluorophenyl)-4-indazolyl]-oxomethyl]amino]methyl]-3-pyridinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 5-[[[1-(4-fluorophenyl)indazole-4-carbonyl]amino]methyl]pyridine-3-carboxylate
SYSTEMATIC NAME: ethyl 5-[[[1-(4-fluorophenyl)indazol-4-yl]carbonylamino]methyl]pyridine-3-carboxylate
MOLECULAR FORMULA: C23H19FN4O3
MOLECULAR WEIGHT: 418.420363
SMILES: CCOC(=O)C1=CC(=CN=C1)CNC(=O)C2=C3C=NN(C3=CC=C2)C4=CC=C(C=C4)F
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Product OPENEYE NAME: 1-(4-fluorophenyl)-N-[[5-(methylcarbamoyl)-3-pyridyl]methyl]indazole-4-carboxamide
CAS Name: 1-(4-fluorophenyl)-N-[[5-(methylcarbamoyl)-3-pyridinyl]methyl]-4-indazolecarboxamide
IUPAC NAME: 1-(4-fluorophenyl)-N-[[5-(methylcarbamoyl)pyridin-3-yl]methyl]indazole-4-carboxamide
SYSTEMATIC NAME: 1-(4-fluorophenyl)-N-[[5-(methylcarbamoyl)pyridin-3-yl]methyl]indazole-4-carboxamide
MOLECULAR FORMULA: C22H18FN5O2
MOLECULAR WEIGHT: 403.409023
SMILES: CNC(=O)C1=CC(=CN=C1)CNC(=O)C2=C3C=NN(C3=CC=C2)C4=CC=C(C=C4)F
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Product OPENEYE NAME: 1-(4-fluorophenyl)-N-[[6-(3-hydroxypropylsulfonyl)-3-pyridyl]methyl]indazole-4-carboxamide
CAS Name: 1-(4-fluorophenyl)-N-[[6-(3-hydroxypropylsulfonyl)-3-pyridinyl]methyl]-4-indazolecarboxamide
IUPAC NAME: 1-(4-fluorophenyl)-N-[[6-(3-hydroxypropylsulfonyl)pyridin-3-yl]methyl]indazole-4-carboxamide
SYSTEMATIC NAME: 1-(4-fluorophenyl)-N-[[6-(3-oxidanylpropylsulfonyl)pyridin-3-yl]methyl]indazole-4-carboxamide
MOLECULAR FORMULA: C23H21FN4O4S
MOLECULAR WEIGHT: 468.500643
SMILES: C1=CC(=C2C=NN(C2=C1)C3=CC=C(C=C3)F)C(=O)NCC4=CN=C(C=C4)S(=O)(=O)CCCO
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Product OPENEYE NAME: 3-bromo-1-(4-fluorophenyl)-N-[(6-methylsulfonyl-3-pyridyl)methyl]indazole-4-carboxamide
CAS Name: 3-bromo-1-(4-fluorophenyl)-N-[(6-methylsulfonyl-3-pyridinyl)methyl]-4-indazolecarboxamide
IUPAC NAME: 3-bromo-1-(4-fluorophenyl)-N-[(6-methylsulfonylpyridin-3-yl)methyl]indazole-4-carboxamide
SYSTEMATIC NAME: 3-bromanyl-1-(4-fluorophenyl)-N-[(6-methylsulfonylpyridin-3-yl)methyl]indazole-4-carboxamide
MOLECULAR FORMULA: C21H16BrFN4O3S
MOLECULAR WEIGHT: 503.344143
SMILES: CS(=O)(=O)C1=NC=C(C=C1)CNC(=O)C2=C3C(=CC=C2)N(N=C3Br)C4=CC=C(C=C4)F
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Product OPENEYE NAME: 1-(4-fluorophenyl)-N-[[3-(propylcarbamoyl)phenyl]methyl]indazole-4-carboxamide
CAS Name: 1-(4-fluorophenyl)-N-[[3-[oxo(propylamino)methyl]phenyl]methyl]-4-indazolecarboxamide
IUPAC NAME: 1-(4-fluorophenyl)-N-[[3-(propylcarbamoyl)phenyl]methyl]indazole-4-carboxamide
SYSTEMATIC NAME: 1-(4-fluorophenyl)-N-[[3-(propylcarbamoyl)phenyl]methyl]indazole-4-carboxamide
MOLECULAR FORMULA: C25H23FN4O2
MOLECULAR WEIGHT: 430.474123
SMILES: CCCNC(=O)C1=CC(=CC=C1)CNC(=O)C2=C3C=NN(C3=CC=C2)C4=CC=C(C=C4)F
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Product OPENEYE NAME: (4aS,8aS)-4-[1-(4-propoxycyclohexyl)-4-piperidyl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
CAS Name: (4aS,8aS)-4-[1-(4-propoxycyclohexyl)-4-piperidinyl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
IUPAC NAME: (4aS,8aS)-4-[1-(4-propoxycyclohexyl)piperidin-4-yl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
SYSTEMATIC NAME: (4aS,8aS)-4-[1-(4-propoxycyclohexyl)piperidin-4-yl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
MOLECULAR FORMULA: C22H38N2O3
MOLECULAR WEIGHT: 378.54872
SMILES: CCCOC1CCC(CC1)N2CCC(CC2)N3[C@H]4CCCC[C@@H]4OCC3=O
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Product OPENEYE NAME: (4aS,8aS)-4-[1-[4-(cyclopropylmethoxy)cyclohexyl]-4-piperidyl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
CAS Name: (4aS,8aS)-4-[1-[4-(cyclopropylmethoxy)cyclohexyl]-4-piperidinyl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
IUPAC NAME: (4aS,8aS)-4-[1-[4-(cyclopropylmethoxy)cyclohexyl]piperidin-4-yl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
SYSTEMATIC NAME: (4aS,8aS)-4-[1-[4-(cyclopropylmethoxy)cyclohexyl]piperidin-4-yl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
MOLECULAR FORMULA: C23H38N2O3
MOLECULAR WEIGHT: 390.55942
SMILES: C1CC[C@H]2[C@H](C1)N(C(=O)CO2)C3CCN(CC3)C4CCC(CC4)OCC5CC5
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Product OPENEYE NAME: (4aS,8aS)-4-[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]-4-piperidyl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
CAS Name: (4aS,8aS)-4-[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]-4-piperidinyl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
IUPAC NAME: (4aS,8aS)-4-[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
SYSTEMATIC NAME: (4aS,8aS)-4-[1-[4-(cyclopropylmethoxymethyl)cyclohexyl]piperidin-4-yl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
MOLECULAR FORMULA: C24H40N2O3
MOLECULAR WEIGHT: 404.586
SMILES: C1CC[C@H]2[C@H](C1)N(C(=O)CO2)C3CCN(CC3)C4CCC(CC4)COCC5CC5
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Product OPENEYE NAME: (4aS,8aS)-4-[1-[4-(2-fluoroethoxymethyl)cyclohexyl]-4-piperidyl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
CAS Name: (4aS,8aS)-4-[1-[4-(2-fluoroethoxymethyl)cyclohexyl]-4-piperidinyl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
IUPAC NAME: (4aS,8aS)-4-[1-[4-(2-fluoroethoxymethyl)cyclohexyl]piperidin-4-yl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
SYSTEMATIC NAME: (4aS,8aS)-4-[1-[4-(2-fluoranylethoxymethyl)cyclohexyl]piperidin-4-yl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
MOLECULAR FORMULA: C22H37FN2O3
MOLECULAR WEIGHT: 396.539183
SMILES: C1CC[C@H]2[C@H](C1)N(C(=O)CO2)C3CCN(CC3)C4CCC(CC4)COCCF
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Product OPENEYE NAME: (4aS,8aS)-4-[1-[4-(2,2-difluoroethoxymethyl)cyclohexyl]-4-piperidyl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
CAS Name: (4aS,8aS)-4-[1-[4-(2,2-difluoroethoxymethyl)cyclohexyl]-4-piperidinyl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
IUPAC NAME: (4aS,8aS)-4-[1-[4-(2,2-difluoroethoxymethyl)cyclohexyl]piperidin-4-yl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
SYSTEMATIC NAME: (4aS,8aS)-4-[1-[4-[2,2-bis(fluoranyl)ethoxymethyl]cyclohexyl]piperidin-4-yl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
MOLECULAR FORMULA: C22H36F2N2O3
MOLECULAR WEIGHT: 414.529646
SMILES: C1CC[C@H]2[C@H](C1)N(C(=O)CO2)C3CCN(CC3)C4CCC(CC4)COCC(F)F
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Product OPENEYE NAME: (4aS,8aS)-4-[1-[4-(cyclobutylmethoxymethyl)cyclohexyl]-4-piperidyl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
CAS Name: (4aS,8aS)-4-[1-[4-(cyclobutylmethoxymethyl)cyclohexyl]-4-piperidinyl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
IUPAC NAME: (4aS,8aS)-4-[1-[4-(cyclobutylmethoxymethyl)cyclohexyl]piperidin-4-yl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
SYSTEMATIC NAME: (4aS,8aS)-4-[1-[4-(cyclobutylmethoxymethyl)cyclohexyl]piperidin-4-yl]-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]oxazin-3-one
MOLECULAR FORMULA: C25H42N2O3
MOLECULAR WEIGHT: 418.61258
SMILES: C1CC[C@H]2[C@H](C1)N(C(=O)CO2)C3CCN(CC3)C4CCC(CC4)COCC5CCC5
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Product OPENEYE NAME: [2-[[2-(4-methoxyphenyl)-3-oxo-6-[[3-(trifluoromethyl)phenyl]methylamino]pyrido[2,3-b]pyrazin-4-yl]amino]-2-oxo-ethyl] acetate
CAS Name: acetic acid [2-[[2-(4-methoxyphenyl)-3-oxo-6-[[3-(trifluoromethyl)phenyl]methylamino]-4-pyrido[2,3-b]pyrazinyl]amino]-2-oxoethyl] ester
IUPAC NAME: [2-[[2-(4-methoxyphenyl)-3-oxo-6-[[3-(trifluoromethyl)phenyl]methylamino]pyrido[2,3-b]pyrazin-4-yl]amino]-2-oxoethyl] acetate
SYSTEMATIC NAME: [2-[[2-(4-methoxyphenyl)-3-oxidanylidene-6-[[3-(trifluoromethyl)phenyl]methylamino]pyrido[2,3-b]pyrazin-4-yl]amino]-2-oxidanylidene-ethyl] ethanoate
MOLECULAR FORMULA: C26H22F3N5O5
MOLECULAR WEIGHT: 541.47859
SMILES: CC(=O)OCC(=O)NN1C2=C(C=CC(=N2)NCC3=CC(=CC=C3)C(F)(F)F)N=C(C1=O)C4=CC=C(C=C4)OC
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