Product OPENEYE NAME: 5-[(E)-but-1-enyl]-1-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
CAS Name: 5-[(E)-but-1-enyl]-1-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]pyrimidine-2,4-dione
IUPAC NAME: 5-[(E)-but-1-enyl]-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
SYSTEMATIC NAME: 5-[(E)-but-1-enyl]-1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]pyrimidine-2,4-dione
MOLECULAR FORMULA: C13H18N2O5
MOLECULAR WEIGHT: 282.29242
SMILES: CC/C=C/C1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O
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Product OPENEYE NAME: (10E)-4-oxo-10-(phenylhydrazono)-6,7,8,9-tetrahydropyrimido[1,2-a]azepine-3-carboxylic acid
CAS Name: (10E)-4-oxo-10-(phenylhydrazinylidene)-6,7,8,9-tetrahydropyrimido[1,2-a]azepine-3-carboxylic acid
IUPAC NAME: (10E)-4-oxo-10-(phenylhydrazinylidene)-6,7,8,9-tetrahydropyrimido[1,2-a]azepine-3-carboxylic acid
SYSTEMATIC NAME: (10E)-4-oxidanylidene-10-(phenylhydrazinylidene)-6,7,8,9-tetrahydropyrimido[1,2-a]azepine-3-carboxylic acid
MOLECULAR FORMULA: C16H16N4O3
MOLECULAR WEIGHT: 312.32324
SMILES: C1CCN2C(=NC=C(C2=O)C(=O)O)/C(=N/NC3=CC=CC=C3)/C1
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CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H15N7Na2O7
MOLECULAR WEIGHT: 535.37674
SMILES: C1=COC(=C1)C2=NN3C(=N2)C4=C(N=C3N)N(N=C4)CCCC5=CC6=C(C=C5)OC(O6)(C(=O)[O-])C(=O)[O-].[Na+].[Na+]
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Product OPENEYE NAME: 3-methyl-5-[(4-methylpiperazin-1-yl)-(4-sec-butylphenyl)methyl]isothiazole
CAS Name: 5-[(4-butan-2-ylphenyl)-(4-methyl-1-piperazinyl)methyl]-3-methylisothiazole
IUPAC NAME: 5-[(4-butan-2-ylphenyl)-(4-methylpiperazin-1-yl)methyl]-3-methyl-1,2-thiazole
SYSTEMATIC NAME: 5-[(4-butan-2-ylphenyl)-(4-methylpiperazin-1-yl)methyl]-3-methyl-1,2-thiazole
MOLECULAR FORMULA: C20H29N3S
MOLECULAR WEIGHT: 343.52936
SMILES: CCC(C)C1=CC=C(C=C1)C(C2=CC(=NS2)C)N3CCN(CC3)C
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Product OPENEYE NAME: 5-[(3-chlorophenyl)-(4-methylpiperazin-1-yl)methyl]-3-methyl-isothiazole
CAS Name: 5-[(3-chlorophenyl)-(4-methyl-1-piperazinyl)methyl]-3-methylisothiazole
IUPAC NAME: 5-[(3-chlorophenyl)-(4-methylpiperazin-1-yl)methyl]-3-methyl-1,2-thiazole
SYSTEMATIC NAME: 5-[(3-chlorophenyl)-(4-methylpiperazin-1-yl)methyl]-3-methyl-1,2-thiazole
MOLECULAR FORMULA: C16H20ClN3S
MOLECULAR WEIGHT: 321.8681
SMILES: CC1=NSC(=C1)C(C2=CC(=CC=C2)Cl)N3CCN(CC3)C
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Product OPENEYE NAME: (2S)-6-amino-2-[2-(6-methoxy-2-naphthyl)propanoylamino]hexanoic acid
CAS Name: (2S)-6-amino-2-[[2-(6-methoxy-2-naphthalenyl)-1-oxopropyl]amino]hexanoic acid
IUPAC NAME: (2S)-6-amino-2-[2-(6-methoxynaphthalen-2-yl)propanoylamino]hexanoic acid
SYSTEMATIC NAME: (2S)-6-azanyl-2-[2-(6-methoxynaphthalen-2-yl)propanoylamino]hexanoic acid
MOLECULAR FORMULA: C20H26N2O4
MOLECULAR WEIGHT: 358.43144
SMILES: CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)N[C@@H](CCCCN)C(=O)O
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Product OPENEYE NAME: sodium (2S)-3,3-dimethyl-7-oxo-6-(2-phenylethylcarbamoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
CAS Name: sodium (2S)-3,3-dimethyl-7-oxo-6-[[oxo-(2-phenylethylamino)methyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
IUPAC NAME: sodium (2S)-3,3-dimethyl-7-oxo-6-(2-phenylethylcarbamoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
SYSTEMATIC NAME: sodium (2S)-3,3-dimethyl-7-oxidanylidene-6-(2-phenylethylcarbamoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
MOLECULAR FORMULA: C17H20N3NaO4S
MOLECULAR WEIGHT: 385.41317
SMILES: CC1([C@@H](N2C(S1)C(C2=O)NC(=O)NCCC3=CC=CC=C3)C(=O)[O-])C.[Na+]
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Product OPENEYE NAME: (2S)-3,3-dimethyl-7-oxo-6-(2-phenylethylcarbamoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
CAS Name: (2S)-3,3-dimethyl-7-oxo-6-[[oxo-(2-phenylethylamino)methyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
IUPAC NAME: (2S)-3,3-dimethyl-7-oxo-6-(2-phenylethylcarbamoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
SYSTEMATIC NAME: (2S)-3,3-dimethyl-7-oxidanylidene-6-(2-phenylethylcarbamoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
MOLECULAR FORMULA: C17H21N3O4S
MOLECULAR WEIGHT: 363.43134
SMILES: CC1([C@@H](N2C(S1)C(C2=O)NC(=O)NCCC3=CC=CC=C3)C(=O)O)C
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Product OPENEYE NAME: sodium (2S)-6-[(4-ethoxycarbonylphenyl)carbamoylamino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
CAS Name: sodium (2S)-6-[[(4-ethoxycarbonylanilino)-oxomethyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
IUPAC NAME: sodium (2S)-6-[(4-ethoxycarbonylphenyl)carbamoylamino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
SYSTEMATIC NAME: sodium (2S)-6-[(4-ethoxycarbonylphenyl)carbamoylamino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
MOLECULAR FORMULA: C18H20N3NaO6S
MOLECULAR WEIGHT: 429.42267
SMILES: CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2C3N(C2=O)[C@H](C(S3)(C)C)C(=O)[O-].[Na+]
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Product OPENEYE NAME: (2S)-6-[(4-ethoxycarbonylphenyl)carbamoylamino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
CAS Name: (2S)-6-[[(4-ethoxycarbonylanilino)-oxomethyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
IUPAC NAME: (2S)-6-[(4-ethoxycarbonylphenyl)carbamoylamino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
SYSTEMATIC NAME: (2S)-6-[(4-ethoxycarbonylphenyl)carbamoylamino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
MOLECULAR FORMULA: C18H21N3O6S
MOLECULAR WEIGHT: 407.44084
SMILES: CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2C3N(C2=O)[C@H](C(S3)(C)C)C(=O)O
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Product OPENEYE NAME: 2-[4-[[4-[(3-chlorothiophene-2-carbonyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrol-2-yl]-N-[2-(1-piperidyl)ethyl]-3H-benzimidazole-5-carboxamide
CAS Name: 2-[4-[[[4-[[(3-chloro-2-thiophenyl)-oxomethyl]amino]-1-methyl-2-pyrrolyl]-oxomethyl]amino]-1-methyl-2-pyrrolyl]-N-[2-(1-piperidinyl)ethyl]-3H-benzimidazole-5-carboxamide
IUPAC NAME: 2-[4-[[4-[(3-chlorothiophene-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]-N-(2-piperidin-1-ylethyl)-3H-benzimidazole-5-carboxamide
SYSTEMATIC NAME: 2-[4-[[4-[(3-chloranylthiophen-2-yl)carbonylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrol-2-yl]-N-(2-piperidin-1-ylethyl)-3H-benzimidazole-5-carboxamide
MOLECULAR FORMULA: C31H33ClN8O3S
MOLECULAR WEIGHT: 633.16352
SMILES: CN1C=C(C=C1C2=NC3=C(N2)C=C(C=C3)C(=O)NCCN4CCCCC4)NC(=O)C5=CC(=CN5C)NC(=O)C6=C(C=CS6)Cl
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Product OPENEYE NAME: sodium (2S)-6-(isopropylcarbamoylamino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
CAS Name: sodium (2S)-3,3-dimethyl-7-oxo-6-[[oxo-(propan-2-ylamino)methyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
IUPAC NAME: sodium (2S)-3,3-dimethyl-7-oxo-6-(propan-2-ylcarbamoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
SYSTEMATIC NAME: sodium (2S)-3,3-dimethyl-7-oxidanylidene-6-(propan-2-ylcarbamoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
MOLECULAR FORMULA: C12H18N3NaO4S
MOLECULAR WEIGHT: 323.34379
SMILES: CC(C)NC(=O)NC1C2N(C1=O)[C@H](C(S2)(C)C)C(=O)[O-].[Na+]
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