Product OPENEYE NAME: 3-bromo-N2-[4-(dimethylamino)butyl]-N1-pyrido[4,3-d]pyrimidin-4-yl-benzene-1,2-diamine
CAS Name: 3-bromo-N2-[4-(dimethylamino)butyl]-N1-(4-pyrido[4,3-d]pyrimidinyl)benzene-1,2-diamine
IUPAC NAME: 3-bromo-2-N-[4-(dimethylamino)butyl]-1-N-pyrido[4,3-d]pyrimidin-4-ylbenzene-1,2-diamine
SYSTEMATIC NAME: 3-bromanyl-N2-[4-(dimethylamino)butyl]-N1-pyrido[4,3-d]pyrimidin-4-yl-benzene-1,2-diamine
MOLECULAR FORMULA: C19H23BrN6
MOLECULAR WEIGHT: 415.33012
SMILES: CN(C)CCCCNC1=C(C=CC=C1Br)NC2=NC=NC3=C2C=NC=C3
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Product OPENEYE NAME: 3-nitro-N1-pyrido[4,3-d]pyrimidin-4-yl-benzene-1,2-diamine
CAS Name: 3-nitro-N1-(4-pyrido[4,3-d]pyrimidinyl)benzene-1,2-diamine
IUPAC NAME: 3-nitro-1-N-pyrido[4,3-d]pyrimidin-4-ylbenzene-1,2-diamine
SYSTEMATIC NAME: 3-nitro-N1-pyrido[4,3-d]pyrimidin-4-yl-benzene-1,2-diamine
MOLECULAR FORMULA: C13H10N6O2
MOLECULAR WEIGHT: 282.2575
SMILES: C1=CC(=C(C(=C1)[N+](=O)[O-])N)NC2=NC=NC3=C2C=NC=C3
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Product OPENEYE NAME: 2-[(6S,9S,12R,15S)-12,15-dibenzyl-9-(3-guanidinopropyl)-6-(1H-indol-3-ylmethyl)-5,8,11,14,17,21-hexaoxo-1,4,7,10,13,16-hexazacyclohenicos-4-yl]acetamide
CAS Name: 2-[(6S,9S,12R,15S)-9-[3-(diaminomethylideneamino)propyl]-6-(1H-indol-3-ylmethyl)-5,8,11,14,17,21-hexaoxo-12,15-bis(phenylmethyl)-1,4,7,10,13,16-hexazacycloheneicos-4-yl]acetamide
IUPAC NAME: 2-[(6S,9S,12R,15S)-12,15-dibenzyl-9-[3-(diaminomethylideneamino)propyl]-6-(1H-indol-3-ylmethyl)-5,8,11,14,17,21-hexaoxo-1,4,7,10,13,16-hexazacyclohenicos-4-yl]acetamide
SYSTEMATIC NAME: 2-[(6S,9S,12R,15S)-9-[3-[bis(azanyl)methylideneamino]propyl]-6-(1H-indol-3-ylmethyl)-5,8,11,14,17,21-hexakis(oxidanylidene)-12,15-bis(phenylmethyl)-1,4,7,10,13,16-hexazacyclohenicos-4-yl]ethanamide
MOLECULAR FORMULA: C44H55N11O7
MOLECULAR WEIGHT: 849.977
SMILES: C1CC(=O)NCCN(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)C1)CC2=CC=CC=C2)CC3=CC=CC=C3)CCCN=C(N)N)CC4=CNC5=CC=CC=C54)CC(=O)N
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Product OPENEYE NAME: (2S)-2-[(1-methyl-2-piperidyl)amino]-8-oxo-N-(4-phenylthiazol-2-yl)nonanamide
CAS Name: (2S)-2-[(1-methyl-2-piperidinyl)amino]-8-oxo-N-(4-phenyl-2-thiazolyl)nonanamide
IUPAC NAME: (2S)-2-[(1-methylpiperidin-2-yl)amino]-8-oxo-N-(4-phenyl-1,3-thiazol-2-yl)nonanamide
SYSTEMATIC NAME: (2S)-2-[(1-methylpiperidin-2-yl)amino]-8-oxidanylidene-N-(4-phenyl-1,3-thiazol-2-yl)nonanamide
MOLECULAR FORMULA: C24H34N4O2S
MOLECULAR WEIGHT: 442.61736
SMILES: CC(=O)CCCCC[C@@H](C(=O)NC1=NC(=CS1)C2=CC=CC=C2)NC3CCCCN3C
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Product OPENEYE NAME: methyl (2S)-2-[(5-methyl-1,1,3-trioxo-4-propyl-1,2,5-thiadiazolidin-2-yl)methylsulfonylamino]propanoate
CAS Name: (2S)-2-[(5-methyl-1,1,3-trioxo-4-propyl-1,2,5-thiadiazolidin-2-yl)methylsulfonylamino]propanoic acid methyl ester
IUPAC NAME: methyl (2S)-2-[(5-methyl-1,1,3-trioxo-4-propyl-1,2,5-thiadiazolidin-2-yl)methylsulfonylamino]propanoate
SYSTEMATIC NAME: methyl (2S)-2-[[5-methyl-1,1,3-tris(oxidanylidene)-4-propyl-1,2,5-thiadiazolidin-2-yl]methylsulfonylamino]propanoate
MOLECULAR FORMULA: C11H21N3O7S2
MOLECULAR WEIGHT: 371.43034
SMILES: CCCC1C(=O)N(S(=O)(=O)N1C)CS(=O)(=O)N[C@@H](C)C(=O)OC
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Product OPENEYE NAME: (2S)-2-[(1-methyl-2-piperidyl)amino]-8-oxo-N-(3-phenylphenyl)nonanamide
CAS Name: (2S)-2-[(1-methyl-2-piperidinyl)amino]-8-oxo-N-(3-phenylphenyl)nonanamide
IUPAC NAME: (2S)-2-[(1-methylpiperidin-2-yl)amino]-8-oxo-N-(3-phenylphenyl)nonanamide
SYSTEMATIC NAME: (2S)-2-[(1-methylpiperidin-2-yl)amino]-8-oxidanylidene-N-(3-phenylphenyl)nonanamide
MOLECULAR FORMULA: C27H37N3O2
MOLECULAR WEIGHT: 435.60158
SMILES: CC(=O)CCCCC[C@@H](C(=O)NC1=CC=CC(=C1)C2=CC=CC=C2)NC3CCCCN3C
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Product OPENEYE NAME: (2S)-8-oxo-N-(3-phenylphenyl)-2-(thiazol-5-ylamino)nonanamide
CAS Name: (2S)-8-oxo-N-(3-phenylphenyl)-2-(5-thiazolylamino)nonanamide
IUPAC NAME: (2S)-8-oxo-N-(3-phenylphenyl)-2-(1,3-thiazol-5-ylamino)nonanamide
SYSTEMATIC NAME: (2S)-8-oxidanylidene-N-(3-phenylphenyl)-2-(1,3-thiazol-5-ylamino)nonanamide
MOLECULAR FORMULA: C24H27N3O2S
MOLECULAR WEIGHT: 421.55508
SMILES: CC(=O)CCCCC[C@@H](C(=O)NC1=CC=CC(=C1)C2=CC=CC=C2)NC3=CN=CS3
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Product OPENEYE NAME: [(3S,4aR,6aR,6bS,8aS,11R,12S,12aS,14aR,14bR)-8a-[3-[4-[3-(dibenzylamino)propyl]piperazin-1-yl]propylcarbamoyl]-4,4,6a,6b,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl] acetate
CAS Name: acetic acid [(3S,4aR,6aR,6bS,8aS,11R,12S,12aS,14aR,14bR)-8a-[[3-[4-[3-[bis(phenylmethyl)amino]propyl]-1-piperazinyl]propylamino]-oxomethyl]-4,4,6a,6b,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl] ester
IUPAC NAME: [(3S,4aR,6aR,6bS,8aS,11R,12S,12aS,14aR,14bR)-8a-[3-[4-[3-(dibenzylamino)propyl]piperazin-1-yl]propylcarbamoyl]-4,4,6a,6b,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl] acetate
SYSTEMATIC NAME: [(3S,4aR,6aR,6bS,8aS,11R,12S,12aS,14aR,14bR)-8a-[3-[4-[3-[bis(phenylmethyl)amino]propyl]piperazin-1-yl]propylcarbamoyl]-4,4,6a,6b,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl] ethanoate
MOLECULAR FORMULA: C56H84N4O3
MOLECULAR WEIGHT: 861.29116
SMILES: C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)OC(=O)C)C)C)[C@@H]2[C@H]1C)C)C(=O)NCCCN6CCN(CC6)CCCN(CC7=CC=CC=C7)CC8=CC=CC=C8
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Product OPENEYE NAME: 2-[4-[[4-[3-chloro-4-(hydroxymethyl)phenoxy]-1-piperidyl]methyl]-1-piperidyl]benzoic acid
CAS Name: 2-[4-[[4-[3-chloro-4-(hydroxymethyl)phenoxy]-1-piperidinyl]methyl]-1-piperidinyl]benzoic acid
IUPAC NAME: 2-[4-[[4-[3-chloro-4-(hydroxymethyl)phenoxy]piperidin-1-yl]methyl]piperidin-1-yl]benzoic acid
SYSTEMATIC NAME: 2-[4-[[4-[3-chloranyl-4-(hydroxymethyl)phenoxy]piperidin-1-yl]methyl]piperidin-1-yl]benzoic acid
MOLECULAR FORMULA: C25H31ClN2O4
MOLECULAR WEIGHT: 458.97764
SMILES: C1CN(CCC1CN2CCC(CC2)OC3=CC(=C(C=C3)CO)Cl)C4=CC=CC=C4C(=O)O
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C46H56N8O6
MOLECULAR WEIGHT: 816.98684
SMILES: CC(=O)NCCCNCCCCNCCN1C(=O)C2=C3C(=CC=C4C3=C(C=C2)C5=C6C4=CC=C7C6=C(C=C5)C(=O)N(C7=O)CCNCCCCNCCCNC(=O)C)C1=O
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Product OPENEYE NAME: 9-methylsulfanyl-8-oxo-N-phenyl-nonanamide
CAS Name: 9-(methylthio)-8-oxo-N-phenylnonanamide
IUPAC NAME: 9-methylsulfanyl-8-oxo-N-phenylnonanamide
SYSTEMATIC NAME: 9-methylsulfanyl-8-oxidanylidene-N-phenyl-nonanamide
MOLECULAR FORMULA: C16H23NO2S
MOLECULAR WEIGHT: 293.42432
SMILES: CSCC(=O)CCCCCCC(=O)NC1=CC=CC=C1
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