Product OPENEYE NAME: 6-methoxy-1,4-dihydroquinazolin-2-amine
CAS Name: 6-methoxy-1,4-dihydroquinazolin-2-amine
IUPAC NAME: 6-methoxy-1,4-dihydroquinazolin-2-amine
SYSTEMATIC NAME: 6-methoxy-1,4-dihydroquinazolin-2-amine
MOLECULAR FORMULA: C9H11N3O
MOLECULAR WEIGHT: 177.20314
SMILES: COC1=CC2=C(C=C1)NC(=NC2)N
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Product OPENEYE NAME: 1-[[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)cyclohexyl]methyl]-1,4,8,11-tetrazacyclotetradecane
CAS Name: 1-[[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)cyclohexyl]methyl]-1,4,8,11-tetrazacyclotetradecane
IUPAC NAME: 1-[[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)cyclohexyl]methyl]-1,4,8,11-tetrazacyclotetradecane
SYSTEMATIC NAME: 1-[[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)cyclohexyl]methyl]-1,4,8,11-tetrazacyclotetradecane
MOLECULAR FORMULA: C28H60N8
MOLECULAR WEIGHT: 508.8296
SMILES: C1CNCCNCCCN(CCNC1)CC2CCC(CC2)CN3CCCNCCNCCCNCC3
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Product OPENEYE NAME: sodium 4-isopentyl-2-[7-(methanesulfonamido)-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-yl]-4-methyl-3-oxo-naphthalen-1-olate
CAS Name: sodium 2-[7-(methanesulfonamido)-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-yl]-4-methyl-4-(3-methylbutyl)-3-oxo-1-naphthalenolate
IUPAC NAME: sodium 2-[7-(methanesulfonamido)-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-yl]-4-methyl-4-(3-methylbutyl)-3-oxonaphthalen-1-olate
SYSTEMATIC NAME: sodium 4-methyl-4-(3-methylbutyl)-2-[7-(methylsulfonylamino)-1,1-bis(oxidanylidene)-4H-1$l^{6},2,4-benzothiadiazin-3-yl]-3-oxidanylidene-naphthalen-1-olate
MOLECULAR FORMULA: C24H26N3NaO6S2
MOLECULAR WEIGHT: 539.59951
SMILES: CC(C)CCC1(C2=CC=CC=C2C(=C(C1=O)C3=NS(=O)(=O)C4=C(N3)C=CC(=C4)NS(=O)(=O)C)[O-])C.[Na+]
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Product OPENEYE NAME: N-[3-(4-isopentyl-4-methyl-1,3-dioxo-tetralin-2-ylidene)-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-7-yl]methanesulfonamide
CAS Name: N-[3-[4-methyl-4-(3-methylbutyl)-1,3-dioxo-2-naphthalenylidene]-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-7-yl]methanesulfonamide
IUPAC NAME: N-[3-[4-methyl-4-(3-methylbutyl)-1,3-dioxonaphthalen-2-ylidene]-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-7-yl]methanesulfonamide
SYSTEMATIC NAME: N-[3-[4-methyl-4-(3-methylbutyl)-1,3-bis(oxidanylidene)naphthalen-2-ylidene]-1,1-bis(oxidanylidene)-4H-1$l^{6},2,4-benzothiadiazin-7-yl]methanesulfonamide
MOLECULAR FORMULA: C24H27N3O6S2
MOLECULAR WEIGHT: 517.61768
SMILES: CC(C)CCC1(C2=CC=CC=C2C(=O)C(=C3NC4=C(C=C(C=C4)NS(=O)(=O)C)S(=O)(=O)N3)C1=O)C
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Product OPENEYE NAME: (2S)-2-[(5Z)-5-[[4-[2-[2-[4-[(Z)-[3-[(1S)-1-carboxy-2-phenyl-ethyl]-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]phenoxy]ethoxy]ethoxy]phenyl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]-3-phenyl-propanoic acid
CAS Name: (2S)-2-[(5Z)-5-[[4-[2-[2-[4-[(Z)-[3-[(1S)-1-carboxy-2-phenylethyl]-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]phenoxy]ethoxy]ethoxy]phenyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-3-phenylpropanoic acid
IUPAC NAME: (2S)-2-[(5Z)-5-[[4-[2-[2-[4-[(Z)-[3-[(1S)-1-carboxy-2-phenylethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]phenoxy]ethoxy]ethoxy]phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenylpropanoic acid
SYSTEMATIC NAME: (2S)-2-[(5Z)-4-oxidanylidene-5-[[4-[2-[2-[4-[(Z)-[4-oxidanylidene-3-[(2S)-1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]phenoxy]ethoxy]ethoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-p
MOLECULAR FORMULA: C42H36N2O9S4
MOLECULAR WEIGHT: 841.00324
SMILES: C1=CC=C(C=C1)C[C@H](N2C(=S)S/C(=C\C3=CC=C(C=C3)OCCOCCOC4=CC=C(C=C4)/C=C/5\SC(=S)N(C5=O)[C@H](C(=O)O)CC6=CC=CC=C6)/C2=O)C(=O)O
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Product OPENEYE NAME: 2-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]phenol
CAS Name: 2-[2-[(2R)-2-methyl-1-pyrrolidinyl]ethyl]phenol
IUPAC NAME: 2-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]phenol
SYSTEMATIC NAME: 2-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]phenol
MOLECULAR FORMULA: C13H19NO
MOLECULAR WEIGHT: 205.29606
SMILES: C[C@@H]1CCCN1CCC2=CC=CC=C2O
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Product OPENEYE NAME: 1-[2-(2,4,6-trimethylphenyl)ethyl]pyrrolidine
CAS Name: 1-[2-(2,4,6-trimethylphenyl)ethyl]pyrrolidine
IUPAC NAME: 1-[2-(2,4,6-trimethylphenyl)ethyl]pyrrolidine
SYSTEMATIC NAME: 1-[2-(2,4,6-trimethylphenyl)ethyl]pyrrolidine
MOLECULAR FORMULA: C15H23N
MOLECULAR WEIGHT: 217.34982
SMILES: CC1=CC(=C(C(=C1)C)CCN2CCCC2)C
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Product OPENEYE NAME: 2-[2-[(2S)-2-methylpyrrolidin-1-yl]ethyl]phenol
CAS Name: 2-[2-[(2S)-2-methyl-1-pyrrolidinyl]ethyl]phenol
IUPAC NAME: 2-[2-[(2S)-2-methylpyrrolidin-1-yl]ethyl]phenol
SYSTEMATIC NAME: 2-[2-[(2S)-2-methylpyrrolidin-1-yl]ethyl]phenol
MOLECULAR FORMULA: C13H19NO
MOLECULAR WEIGHT: 205.29606
SMILES: C[C@H]1CCCN1CCC2=CC=CC=C2O
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Product OPENEYE NAME: (2S)-2-methyl-1-[2-(2,4,6-trimethylphenyl)ethyl]pyrrolidine
CAS Name: (2S)-2-methyl-1-[2-(2,4,6-trimethylphenyl)ethyl]pyrrolidine
IUPAC NAME: (2S)-2-methyl-1-[2-(2,4,6-trimethylphenyl)ethyl]pyrrolidine
SYSTEMATIC NAME: (2S)-2-methyl-1-[2-(2,4,6-trimethylphenyl)ethyl]pyrrolidine
MOLECULAR FORMULA: C16H25N
MOLECULAR WEIGHT: 231.3764
SMILES: C[C@H]1CCCN1CCC2=C(C=C(C=C2C)C)C
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Product OPENEYE NAME: 6-[2-(2-chloro-6-fluoro-phenyl)-5-phenyl-1H-imidazol-4-yl]-1-isopropylsulfonyl-benzimidazol-2-amine; methanesulfonic acid
CAS Name: 6-[2-(2-chloro-6-fluorophenyl)-5-phenyl-1H-imidazol-4-yl]-1-propan-2-ylsulfonyl-2-benzimidazolamine; methanesulfonic acid
IUPAC NAME: 6-[2-(2-chloro-6-fluorophenyl)-5-phenyl-1H-imidazol-4-yl]-1-propan-2-ylsulfonylbenzimidazol-2-amine; methanesulfonic acid
SYSTEMATIC NAME: 6-[2-(2-chloranyl-6-fluoranyl-phenyl)-5-phenyl-1H-imidazol-4-yl]-1-propan-2-ylsulfonyl-benzimidazol-2-amine; methanesulfonic acid
MOLECULAR FORMULA: C26H25ClFN5O5S2
MOLECULAR WEIGHT: 606.088603
SMILES: CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)C3=C(NC(=N3)C4=C(C=CC=C4Cl)F)C5=CC=CC=C5)N=C1N.CS(=O)(=O)O
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Product OPENEYE NAME: 2-(chloromethyl)-5-[4-(imidazol-1-ylmethyl)phenyl]pyridine
CAS Name: 2-(chloromethyl)-5-[4-(1-imidazolylmethyl)phenyl]pyridine
IUPAC NAME: 2-(chloromethyl)-5-[4-(imidazol-1-ylmethyl)phenyl]pyridine
SYSTEMATIC NAME: 2-(chloromethyl)-5-[4-(imidazol-1-ylmethyl)phenyl]pyridine
MOLECULAR FORMULA: C16H14ClN3
MOLECULAR WEIGHT: 283.75546
SMILES: C1=CC(=CC=C1CN2C=CN=C2)C3=CN=C(C=C3)CCl
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Product OPENEYE NAME: N-[(1S)-1-[2-[4-[(3S,4R)-1-acetyl-4-(4-chlorophenyl)pyrrolidine-3-carbonyl]piperazin-1-yl]-5-methyl-phenyl]-2-methyl-propyl]-3-(dimethylamino)propanamide
CAS Name: N-[(1S)-1-[2-[4-[[(3S,4R)-1-acetyl-4-(4-chlorophenyl)-3-pyrrolidinyl]-oxomethyl]-1-piperazinyl]-5-methylphenyl]-2-methylpropyl]-3-(dimethylamino)propanamide
IUPAC NAME: N-[(1S)-1-[2-[4-[(3S,4R)-1-acetyl-4-(4-chlorophenyl)pyrrolidine-3-carbonyl]piperazin-1-yl]-5-methylphenyl]-2-methylpropyl]-3-(dimethylamino)propanamide
SYSTEMATIC NAME: N-[(1S)-1-[2-[4-[(3S,4R)-4-(4-chlorophenyl)-1-ethanoyl-pyrrolidin-3-yl]carbonylpiperazin-1-yl]-5-methyl-phenyl]-2-methyl-propyl]-3-(dimethylamino)propanamide
MOLECULAR FORMULA: C33H46ClN5O3
MOLECULAR WEIGHT: 596.20304
SMILES: CC1=CC(=C(C=C1)N2CCN(CC2)C(=O)[C@@H]3CN(C[C@H]3C4=CC=C(C=C4)Cl)C(=O)C)[C@H](C(C)C)NC(=O)CCN(C)C
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Product OPENEYE NAME: (2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-guanidino-pentanoyl]amino]-3-phenyl-propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-guanidino-pentanoyl]amino]-3-methyl-pentanoyl]amino]hexanamide
CAS Name: (2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)-1-oxopentyl]amino]-1-oxo-3-phenylpropyl]amino]-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-5-(diaminomethylideneamino)-1-oxopentyl]amino]-3-methyl-1-oxopentyl]amin
IUPAC NAME: (2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-3-phenylpropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylpentanoyl]amino]hexanamide
SYSTEMATIC NAME: (2S)-6-azanyl-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-3-phenyl-propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-3-methyl-pentanoyl]amino]h
MOLECULAR FORMULA: C42H68N14O7
MOLECULAR WEIGHT: 881.07892
SMILES: CC[C@H](C)[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCN=C(N)N)N
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Product OPENEYE NAME: 4-[2-[1-benzhydryl-5-chloro-2-[2-[(2-fluorophenyl)sulfonylamino]ethyl]indol-3-yl]ethoxy]benzoic acid
CAS Name: 4-[2-[5-chloro-1-(diphenylmethyl)-2-[2-[(2-fluorophenyl)sulfonylamino]ethyl]-3-indolyl]ethoxy]benzoic acid
IUPAC NAME: 4-[2-[1-benzhydryl-5-chloro-2-[2-[(2-fluorophenyl)sulfonylamino]ethyl]indol-3-yl]ethoxy]benzoic acid
SYSTEMATIC NAME: 4-[2-[5-chloranyl-1-(diphenylmethyl)-2-[2-[(2-fluorophenyl)sulfonylamino]ethyl]indol-3-yl]ethoxy]benzoic acid
MOLECULAR FORMULA: C38H32ClFN2O5S
MOLECULAR WEIGHT: 683.187483
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)N3C4=C(C=C(C=C4)Cl)C(=C3CCNS(=O)(=O)C5=CC=CC=C5F)CCOC6=CC=C(C=C6)C(=O)O
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Product OPENEYE NAME: (2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-5-guanidino-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-guanidino-2-(hexanoylamino)pentanoyl]amino]-3-phenyl-propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]pentanoyl]amino]-3-methyl-pentanoyl]amino]hexanamide
CAS Name: (2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-(diaminomethylideneamino)-1-oxo-2-(1-oxohexylamino)pentyl]amino]-1-oxo-3-phenylpropyl]amino]-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopentyl]amino]-3-methyl-1-ox
IUPAC NAME: (2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-(diaminomethylideneamino)-2-(hexanoylamino)pentanoyl]amino]-3-phenylpropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]pentanoyl]amino]-3-methylpentanoyl]amino]hex
SYSTEMATIC NAME: (2S)-6-azanyl-2-[[(2S,3S)-2-[[(2S)-5-[bis(azanyl)methylideneamino]-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-[bis(azanyl)methylideneamino]-2-(hexanoylamino)pentanoyl]amino]-3-phenyl-propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]pentanoyl]amino]-3-methyl-pentanoy
MOLECULAR FORMULA: C48H78N14O8
MOLECULAR WEIGHT: 979.22192
SMILES: CCCCCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N
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Product OPENEYE NAME: (2S)-2-amino-N-[2-[[4-[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]ethylamino]-9,10-dioxo-1-anthryl]amino]ethyl]-3-(4-hydroxyphenyl)propanamide
CAS Name: (2S)-2-amino-N-[2-[[4-[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]ethylamino]-9,10-dioxo-1-anthracenyl]amino]ethyl]-3-(4-hydroxyphenyl)propanamide
IUPAC NAME: (2S)-2-amino-N-[2-[[4-[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]ethylamino]-9,10-dioxoanthracen-1-yl]amino]ethyl]-3-(4-hydroxyphenyl)propanamide
SYSTEMATIC NAME: (2S)-2-azanyl-N-[2-[[4-[2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]ethylamino]-9,10-bis(oxidanylidene)anthracen-1-yl]amino]ethyl]-3-(4-hydroxyphenyl)propanamide
MOLECULAR FORMULA: C36H38N6O6
MOLECULAR WEIGHT: 650.72352
SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NCCNC(=O)[C@H](CC4=CC=C(C=C4)O)N)NCCNC(=O)[C@H](CC5=CC=C(C=C5)O)N
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