Product OPENEYE NAME: diethyl (2S)-2-[[4-[2-[(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)sulfanylmethyl]cyclobutyl]benzoyl]amino]pentanedioate
CAS Name: (2S)-2-[[[4-[2-[[(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)thio]methyl]cyclobutyl]phenyl]-oxomethyl]amino]pentanedioic acid diethyl ester
IUPAC NAME: diethyl (2S)-2-[[4-[2-[(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)sulfanylmethyl]cyclobutyl]benzoyl]amino]pentanedioate
SYSTEMATIC NAME: diethyl (2S)-2-[[4-[2-[[2,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]sulfanylmethyl]cyclobutyl]phenyl]carbonylamino]pentanedioate
MOLECULAR FORMULA: C25H33N5O6S
MOLECULAR WEIGHT: 531.62442
SMILES: CCOC(=O)CC[C@@H](C(=O)OCC)NC(=O)C1=CC=C(C=C1)C2CCC2CSC3=C(NC(=NC3=O)N)N
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MOLECULAR FORMULA: C128H144N8O4-2
MOLECULAR WEIGHT: 1858.56416
SMILES: CCCCCCCCCCCCOC1=C(C=C2C(=C1)C3=NC4=C5C(=C(C(=C(C5=C([N-]4)N=C6C7=CC(=C(C=C7C(=N6)N=C8C9=C(C(=C(C(=C9C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1)C(=NC2=N3)[N-]8)OCCCCCCCCCCCC)OCCCCCCCCCCCC)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1)OCCCCCCCCCCCC
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Product OPENEYE NAME: ethyl (Z)-2-benzamido-3-(dimethylamino)prop-2-enoate
CAS Name: (Z)-2-benzamido-3-(dimethylamino)-2-propenoic acid ethyl ester
IUPAC NAME: ethyl (Z)-2-benzamido-3-(dimethylamino)prop-2-enoate
SYSTEMATIC NAME: ethyl (Z)-2-benzamido-3-(dimethylamino)prop-2-enoate
MOLECULAR FORMULA: C14H18N2O3
MOLECULAR WEIGHT: 262.30432
SMILES: CCOC(=O)/C(=C/N(C)C)/NC(=O)C1=CC=CC=C1
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Product OPENEYE NAME: methyl 2-benzoylimino-2-(hydroxyamino)acetate
CAS Name: 2-benzoylimino-2-(hydroxyamino)acetic acid methyl ester
IUPAC NAME: methyl 2-benzoylimino-2-(hydroxyamino)acetate
SYSTEMATIC NAME: methyl 2-(oxidanylamino)-2-(phenylcarbonylimino)ethanoate
MOLECULAR FORMULA: C10H10N2O4
MOLECULAR WEIGHT: 222.1974
SMILES: COC(=O)C(=NC(=O)C1=CC=CC=C1)NO
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Product OPENEYE NAME: ethyl 2-benzoylimino-2-(hydroxyamino)acetate
CAS Name: 2-benzoylimino-2-(hydroxyamino)acetic acid ethyl ester
IUPAC NAME: ethyl 2-benzoylimino-2-(hydroxyamino)acetate
SYSTEMATIC NAME: ethyl 2-(oxidanylamino)-2-(phenylcarbonylimino)ethanoate
MOLECULAR FORMULA: C11H12N2O4
MOLECULAR WEIGHT: 236.22398
SMILES: CCOC(=O)C(=NC(=O)C1=CC=CC=C1)NO
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Product OPENEYE NAME: methyl 2-acetylimino-2-(hydroxyamino)acetate
CAS Name: 2-acetylimino-2-(hydroxyamino)acetic acid methyl ester
IUPAC NAME: methyl 2-acetylimino-2-(hydroxyamino)acetate
SYSTEMATIC NAME: methyl 2-ethanoylimino-2-(oxidanylamino)ethanoate
MOLECULAR FORMULA: C5H8N2O4
MOLECULAR WEIGHT: 160.12802
SMILES: CC(=O)N=C(C(=O)OC)NO
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Product OPENEYE NAME: 4-(2-acetoxyethyl)-5-[[3-(2-acetoxyethyl)-5-carboxy-4-methyl-1H-pyrrol-2-yl]methyl]-3-methyl-1H-pyrrole-2-carboxylic acid
CAS Name: 4-(2-acetyloxyethyl)-5-[[3-(2-acetyloxyethyl)-5-carboxy-4-methyl-1H-pyrrol-2-yl]methyl]-3-methyl-1H-pyrrole-2-carboxylic acid
IUPAC NAME: 4-(2-acetyloxyethyl)-5-[[3-(2-acetyloxyethyl)-5-carboxy-4-methyl-1H-pyrrol-2-yl]methyl]-3-methyl-1H-pyrrole-2-carboxylic acid
SYSTEMATIC NAME: 4-(2-acetyloxyethyl)-5-[[3-(2-acetyloxyethyl)-5-carboxy-4-methyl-1H-pyrrol-2-yl]methyl]-3-methyl-1H-pyrrole-2-carboxylic acid
MOLECULAR FORMULA: C21H26N2O8
MOLECULAR WEIGHT: 434.43974
SMILES: CC1=C(NC(=C1CCOC(=O)C)CC2=C(C(=C(N2)C(=O)O)C)CCOC(=O)C)C(=O)O
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Product OPENEYE NAME: 3-(2-acetoxyethyl)-5-[[4-(2-acetoxyethyl)-5-carboxy-3-methyl-1H-pyrrol-2-yl]methyl]-4-methyl-1H-pyrrole-2-carboxylic acid
CAS Name: 3-(2-acetyloxyethyl)-5-[[4-(2-acetyloxyethyl)-5-carboxy-3-methyl-1H-pyrrol-2-yl]methyl]-4-methyl-1H-pyrrole-2-carboxylic acid
IUPAC NAME: 3-(2-acetyloxyethyl)-5-[[4-(2-acetyloxyethyl)-5-carboxy-3-methyl-1H-pyrrol-2-yl]methyl]-4-methyl-1H-pyrrole-2-carboxylic acid
SYSTEMATIC NAME: 3-(2-acetyloxyethyl)-5-[[4-(2-acetyloxyethyl)-5-carboxy-3-methyl-1H-pyrrol-2-yl]methyl]-4-methyl-1H-pyrrole-2-carboxylic acid
MOLECULAR FORMULA: C21H26N2O8
MOLECULAR WEIGHT: 434.43974
SMILES: CC1=C(NC(=C1CCOC(=O)C)C(=O)O)CC2=C(C(=C(N2)C(=O)O)CCOC(=O)C)C
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MOLECULAR FORMULA: C28H24N4O4S
MOLECULAR WEIGHT: 512.57956
SMILES: COC(=O)[C@H]1C23N(CCN2C(=O)N(C(=O)N3C4=CC=CC=C4)C5=CC=CC=C5)C(=CS1)C6=CC=CC=C6
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MOLECULAR FORMULA: C28H24N4O4S
MOLECULAR WEIGHT: 512.57956
SMILES: COC(=O)C1C23N(CCN2C(=O)N(C(=O)N3C4=CC=CC=C4)C5=CC=CC=C5)C(=CS1)C6=CC=CC=C6
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MOLECULAR FORMULA: C28H24N4O3S
MOLECULAR WEIGHT: 496.58016
SMILES: CC(=O)[C@H]1[C@@]23N(CCN2C(=O)N(C(=O)N3C4=CC=CC=C4)C5=CC=CC=C5)C(=CS1)C6=CC=CC=C6
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MOLECULAR FORMULA: C31H28N4O5S
MOLECULAR WEIGHT: 568.64282
SMILES: CCOC(=O)CC(=O)[C@H]1[C@@]23N(CCN2C(=O)N(C(=O)N3C4=CC=CC=C4)C5=CC=CC=C5)C(=CS1)C6=CC=CC=C6
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Product OPENEYE NAME: 1-[(Z)-(3,4-diphenylthiazol-2-ylidene)-phenyl-ammonio]-N-phenyl-methanimidothioate
CAS Name: 1-[(Z)-(3,4-diphenyl-2-thiazolylidene)-phenylammonio]-N-phenylmethanimidothioate
IUPAC NAME: 1-[(Z)-(3,4-diphenyl-1,3-thiazol-2-ylidene)-phenylazaniumyl]-N-phenylmethanimidothioate
SYSTEMATIC NAME: 1-[(Z)-(3,4-diphenyl-1,3-thiazol-2-ylidene)-phenyl-azaniumyl]-N-phenyl-methanimidothioate
MOLECULAR FORMULA: C28H21N3S2
MOLECULAR WEIGHT: 463.61644
SMILES: C1=CC=C(C=C1)C2=CS/C(=[N+](/C3=CC=CC=C3)\C(=NC4=CC=CC=C4)[S-])/N2C5=CC=CC=C5
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Product OPENEYE NAME: (Z)-(3,4-diphenylthiazol-2-ylidene)-phenyl-(phenylcarbamothioyl)ammonium
CAS Name: (Z)-[anilino(sulfanylidene)methyl]-(3,4-diphenyl-2-thiazolylidene)-phenylammonium
IUPAC NAME: (Z)-(3,4-diphenyl-1,3-thiazol-2-ylidene)-phenyl-(phenylcarbamothioyl)azanium
SYSTEMATIC NAME: (Z)-(3,4-diphenyl-1,3-thiazol-2-ylidene)-phenyl-(phenylcarbamothioyl)azanium
MOLECULAR FORMULA: C28H22N3S2+
MOLECULAR WEIGHT: 464.62438
SMILES: C1=CC=C(C=C1)C2=CS/C(=[N+](/C3=CC=CC=C3)\C(=S)NC4=CC=CC=C4)/N2C5=CC=CC=C5
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