Product OPENEYE NAME: tert-butyl 7-[[5-(aminomethyl)-4,5-dihydro-1H-imidazol-2-yl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 7-[[5-(aminomethyl)-4,5-dihydro-1H-imidazol-2-yl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester
IUPAC NAME: tert-butyl 7-[[5-(aminomethyl)-4,5-dihydro-1H-imidazol-2-yl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: tert-butyl 7-[[5-(aminomethyl)-4,5-dihydro-1H-imidazol-2-yl]amino]-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C16H25N5O3S
MOLECULAR WEIGHT: 367.4664
SMILES: CC1=C(N2C(C(C2=O)NC3=NCC(N3)CN)SC1)C(=O)OC(C)(C)C
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Product OPENEYE NAME: tert-butyl 7-amino-3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 7-amino-3-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester
IUPAC NAME: tert-butyl 7-amino-3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: tert-butyl 7-azanyl-3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C18H24N4O3S2
MOLECULAR WEIGHT: 408.53816
SMILES: CC1=CC(=NC(=N1)SCC2=C(N3C(C(C3=O)N)SC2)C(=O)OC(C)(C)C)C
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Product OPENEYE NAME: 7-(1H-imidazol-2-ylamino)-8-oxo-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-(1H-imidazol-2-ylamino)-8-oxo-3-[(1,3,4-thiadiazol-2-ylthio)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-(1H-imidazol-2-ylamino)-8-oxo-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-(1H-imidazol-2-ylamino)-8-oxidanylidene-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C13H12N6O3S3
MOLECULAR WEIGHT: 396.46778
SMILES: C1C(=C(N2C(S1)C(C2=O)NC3=NC=CN3)C(=O)O)CSC4=NN=CS4
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Product OPENEYE NAME: 2-aminocyclohexanone oxime
CAS Name: 2-amino-1-cyclohexanone oxime
IUPAC NAME: (NZ)-N-(2-aminocyclohexylidene)hydroxylamine
SYSTEMATIC NAME: (NZ)-N-(2-azanylcyclohexylidene)hydroxylamine
MOLECULAR FORMULA: C6H12N2O
MOLECULAR WEIGHT: 128.17228
SMILES: C1CC/C(=N/O)/C(C1)N
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Product OPENEYE NAME: 3-(acetoxymethyl)-7-[[5-(hydroxymethyl)-1H-imidazol-2-yl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 3-(acetyloxymethyl)-7-[[5-(hydroxymethyl)-1H-imidazol-2-yl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 3-(acetyloxymethyl)-7-[[5-(hydroxymethyl)-1H-imidazol-2-yl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 3-(acetyloxymethyl)-7-[[5-(hydroxymethyl)-1H-imidazol-2-yl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C14H16N4O6S
MOLECULAR WEIGHT: 368.36504
SMILES: CC(=O)OCC1=C(N2C(C(C2=O)NC3=NC=C(N3)CO)SC1)C(=O)O
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Product OPENEYE NAME: 1-[4-(dimethylamino)phenyl]ethane-1,2-diamine
CAS Name: 1-[4-(dimethylamino)phenyl]ethane-1,2-diamine
IUPAC NAME: 1-[4-(dimethylamino)phenyl]ethane-1,2-diamine
SYSTEMATIC NAME: 1-[4-(dimethylamino)phenyl]ethane-1,2-diamine
MOLECULAR FORMULA: C10H17N3
MOLECULAR WEIGHT: 179.26208
SMILES: CN(C)C1=CC=C(C=C1)C(CN)N
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Product OPENEYE NAME: (3E)-N-trimethylsilyl-3-trimethylsilyloxyimino-butan-2-amine
CAS Name: (3E)-N-trimethylsilyl-3-trimethylsilyloxyimino-2-butanamine
IUPAC NAME: (3E)-N-trimethylsilyl-3-trimethylsilyloxyiminobutan-2-amine
SYSTEMATIC NAME: (3E)-N-trimethylsilyl-3-trimethylsilyloxyimino-butan-2-amine
MOLECULAR FORMULA: C10H26N2OSi2
MOLECULAR WEIGHT: 246.49724
SMILES: CC(/C(=N/O[Si](C)(C)C)/C)N[Si](C)(C)C
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Product OPENEYE NAME: 7-[[5-(4-cyanophenyl)-4,5-dihydro-1H-imidazol-2-yl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-[[5-(4-cyanophenyl)-4,5-dihydro-1H-imidazol-2-yl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-[[5-(4-cyanophenyl)-4,5-dihydro-1H-imidazol-2-yl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-[[5-(4-cyanophenyl)-4,5-dihydro-1H-imidazol-2-yl]amino]-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C18H17N5O3S
MOLECULAR WEIGHT: 383.42428
SMILES: CC1=C(N2C(C(C2=O)NC3=NCC(N3)C4=CC=C(C=C4)C#N)SC1)C(=O)O
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Product OPENEYE NAME: 3-(acetoxymethyl)-7-[[5-[4-(dimethylamino)phenyl]-1H-imidazol-2-yl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 3-(acetyloxymethyl)-7-[[5-[4-(dimethylamino)phenyl]-1H-imidazol-2-yl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 3-(acetyloxymethyl)-7-[[5-[4-(dimethylamino)phenyl]-1H-imidazol-2-yl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 3-(acetyloxymethyl)-7-[[5-[4-(dimethylamino)phenyl]-1H-imidazol-2-yl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C21H23N5O5S
MOLECULAR WEIGHT: 457.50282
SMILES: CC(=O)OCC1=C(N2C(C(C2=O)NC3=NC=C(N3)C4=CC=C(C=C4)N(C)C)SC1)C(=O)O
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Product OPENEYE NAME: 9,9-dihydroxybenzo[b]triphenylen-14-one
CAS Name: 9,9-dihydroxy-14-benzo[b]triphenylenone
IUPAC NAME: 9,9-dihydroxybenzo[b]triphenylen-14-one
SYSTEMATIC NAME: 9,9-bis(oxidanyl)benzo[b]triphenylen-14-one
MOLECULAR FORMULA: C22H14O3
MOLECULAR WEIGHT: 326.34476
SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2C(=O)C5=CC=CC=C5C4(O)O
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Product OPENEYE NAME: molybdenum; pyridin-1-ium
CAS Name: molybdenum; pyridin-1-ium
IUPAC NAME: molybdenum; pyridin-1-ium
SYSTEMATIC NAME: molybdenum; pyridin-1-ium
MOLECULAR FORMULA: C5H6MoN+
MOLECULAR WEIGHT: 176.04784
SMILES: C1=CC=[NH+]C=C1.[Mo]
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Product OPENEYE NAME: 3-bromo-2-methoxy-cyclohex-3-en-1-one
CAS Name: 3-bromo-2-methoxy-1-cyclohex-3-enone
IUPAC NAME: 3-bromo-2-methoxycyclohex-3-en-1-one
SYSTEMATIC NAME: 3-bromanyl-2-methoxy-cyclohex-3-en-1-one
MOLECULAR FORMULA: C7H9BrO2
MOLECULAR WEIGHT: 205.04916
SMILES: COC1C(=O)CCC=C1Br
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Product OPENEYE NAME: 3-(azepan-1-yl)phenol
CAS Name: 3-(1-azepanyl)phenol
IUPAC NAME: 3-(azepan-1-yl)phenol
SYSTEMATIC NAME: 3-(azepan-1-yl)phenol
MOLECULAR FORMULA: C12H17NO
MOLECULAR WEIGHT: 191.26948
SMILES: C1CCCN(CC1)C2=CC(=CC=C2)O
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Product OPENEYE NAME: 3-chloro-2-methoxy-cyclohex-3-en-1-one
CAS Name: 3-chloro-2-methoxy-1-cyclohex-3-enone
IUPAC NAME: 3-chloro-2-methoxycyclohex-3-en-1-one
SYSTEMATIC NAME: 3-chloranyl-2-methoxy-cyclohex-3-en-1-one
MOLECULAR FORMULA: C7H9ClO2
MOLECULAR WEIGHT: 160.59816
SMILES: COC1C(=O)CCC=C1Cl
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Product OPENEYE NAME: 2-[N-[(4-hydroxyphenyl)methoxycarbonyl]anilino]acetic acid
CAS Name: 2-(N-[(4-hydroxyphenyl)methoxy-oxomethyl]anilino)acetic acid
IUPAC NAME: 2-[N-[(4-hydroxyphenyl)methoxycarbonyl]anilino]acetic acid
SYSTEMATIC NAME: 2-[(4-hydroxyphenyl)methoxycarbonyl-phenyl-amino]ethanoic acid
MOLECULAR FORMULA: C16H15NO5
MOLECULAR WEIGHT: 301.294
SMILES: C1=CC=C(C=C1)N(CC(=O)O)C(=O)OCC2=CC=C(C=C2)O
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Product OPENEYE NAME: 3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-7-(3,3,3-trifluoropropanethioylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 3-[[(1-methyl-5-tetrazolyl)thio]methyl]-8-oxo-7-[(3,3,3-trifluoro-1-sulfanylidenepropyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-7-(3,3,3-trifluoropropanethioylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-8-oxidanylidene-7-[3,3,3-tris(fluoranyl)propanethioylamino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C13H13F3N6O3S3
MOLECULAR WEIGHT: 454.47093
SMILES: CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)NC(=S)CC(F)(F)F)SC2)C(=O)O
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Product OPENEYE NAME: 3-(acetoxymethyl)-7-(3-cyanopropanethioylamino)-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 3-(acetyloxymethyl)-7-[(3-cyano-1-sulfanylidenepropyl)amino]-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 3-(acetyloxymethyl)-7-(3-cyanopropanethioylamino)-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 3-(acetyloxymethyl)-7-(3-cyanopropanethioylamino)-7-methoxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C15H17N3O6S2
MOLECULAR WEIGHT: 399.44198
SMILES: CC(=O)OCC1=C(N2C(C(C2=O)(NC(=S)CCC#N)OC)SC1)C(=O)O
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Product OPENEYE NAME: 2-(N-benzyloxycarbonyl-4-hydroxy-anilino)acetic acid
CAS Name: 2-(4-hydroxy-N-phenylmethoxycarbonylanilino)acetic acid
IUPAC NAME: 2-(4-hydroxy-N-phenylmethoxycarbonylanilino)acetic acid
SYSTEMATIC NAME: 2-[(4-hydroxyphenyl)-phenylmethoxycarbonyl-amino]ethanoic acid
MOLECULAR FORMULA: C16H15NO5
MOLECULAR WEIGHT: 301.294
SMILES: C1=CC=C(C=C1)COC(=O)N(CC(=O)O)C2=CC=C(C=C2)O
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Product OPENEYE NAME: 2-(thiadiazol-4-yl)benzaldehyde
CAS Name: 2-(4-thiadiazolyl)benzaldehyde
IUPAC NAME: 2-(thiadiazol-4-yl)benzaldehyde
SYSTEMATIC NAME: 2-(1,2,3-thiadiazol-4-yl)benzaldehyde
MOLECULAR FORMULA: C9H6N2OS
MOLECULAR WEIGHT: 190.22174
SMILES: C1=CC=C(C(=C1)C=O)C2=CSN=N2
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Product OPENEYE NAME: 3-cyanopropanethioic S-acid
CAS Name: 3-cyanopropanethioic S-acid
IUPAC NAME: 3-cyanopropanethioic S-acid
SYSTEMATIC NAME: 3-cyanopropanethioic S-acid
MOLECULAR FORMULA: C4H5NOS
MOLECULAR WEIGHT: 115.1536
SMILES: C(CC(=O)S)C#N
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Product OPENEYE NAME: 2-(N-formyl-4-hydroxy-anilino)acetic acid
CAS Name: 2-(N-formyl-4-hydroxyanilino)acetic acid
IUPAC NAME: 2-(N-formyl-4-hydroxyanilino)acetic acid
SYSTEMATIC NAME: 2-[(4-hydroxyphenyl)-methanoyl-amino]ethanoic acid
MOLECULAR FORMULA: C9H9NO4
MOLECULAR WEIGHT: 195.17206
SMILES: C1=CC(=CC=C1N(CC(=O)O)C=O)O
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Product OPENEYE NAME: 7-amino-3-(1H-benzimidazol-2-ylsulfanylmethyl)-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-amino-3-[(1H-benzimidazol-2-ylthio)methyl]-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-amino-3-(1H-benzimidazol-2-ylsulfanylmethyl)-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-azanyl-3-(1H-benzimidazol-2-ylsulfanylmethyl)-7-methoxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C16H16N4O4S2
MOLECULAR WEIGHT: 392.45264
SMILES: COC1(C2N(C1=O)C(=C(CS2)CSC3=NC4=CC=CC=C4N3)C(=O)O)N
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Product OPENEYE NAME: 1,3-dibenzyl-5-chlorocarbonyl-2-oxo-imidazolidine-4-carboxylate
CAS Name: 5-carbonochloridoyl-2-oxo-1,3-bis(phenylmethyl)-4-imidazolidinecarboxylate
IUPAC NAME: 1,3-dibenzyl-5-carbonochloridoyl-2-oxoimidazolidine-4-carboxylate
SYSTEMATIC NAME: 5-carbonochloridoyl-2-oxidanylidene-1,3-bis(phenylmethyl)imidazolidine-4-carboxylate
MOLECULAR FORMULA: C19H16ClN2O4-
MOLECULAR WEIGHT: 371.79434
SMILES: C1=CC=C(C=C1)CN2C(C(N(C2=O)CC3=CC=CC=C3)C(=O)Cl)C(=O)[O-]
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Product OPENEYE NAME: 1,3-dibenzyl-5-chlorocarbonyl-2-oxo-imidazolidine-4-carboxylic acid
CAS Name: 5-carbonochloridoyl-2-oxo-1,3-bis(phenylmethyl)-4-imidazolidinecarboxylic acid
IUPAC NAME: 1,3-dibenzyl-5-carbonochloridoyl-2-oxoimidazolidine-4-carboxylic acid
SYSTEMATIC NAME: 5-carbonochloridoyl-2-oxidanylidene-1,3-bis(phenylmethyl)imidazolidine-4-carboxylic acid
MOLECULAR FORMULA: C19H17ClN2O4
MOLECULAR WEIGHT: 372.80228
SMILES: C1=CC=C(C=C1)CN2C(C(N(C2=O)CC3=CC=CC=C3)C(=O)Cl)C(=O)O
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