Product OPENEYE NAME: 2-(3,4-diaminophenyl)acetamide
CAS Name: 2-(3,4-diaminophenyl)acetamide
IUPAC NAME: 2-(3,4-diaminophenyl)acetamide
SYSTEMATIC NAME: 2-[3,4-bis(azanyl)phenyl]ethanamide
MOLECULAR FORMULA: C8H11N3O
MOLECULAR WEIGHT: 165.19244
SMILES: C1=CC(=C(C=C1CC(=O)N)N)N
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Product OPENEYE NAME: tert-butyl 3-(acetoxymethyl)-7-(4,5-dihydro-1H-imidazol-2-ylamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate hydrochloride
CAS Name: 3-(acetyloxymethyl)-7-(4,5-dihydro-1H-imidazol-2-ylamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester hydrochloride
IUPAC NAME: tert-butyl 3-(acetyloxymethyl)-7-(4,5-dihydro-1H-imidazol-2-ylamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate hydrochloride
SYSTEMATIC NAME: tert-butyl 3-(acetyloxymethyl)-7-(4,5-dihydro-1H-imidazol-2-ylamino)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate hydrochloride
MOLECULAR FORMULA: C17H25ClN4O5S
MOLECULAR WEIGHT: 432.9222
SMILES: CC(=O)OCC1=C(N2C(C(C2=O)NC3=NCCN3)SC1)C(=O)OC(C)(C)C.Cl
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Product OPENEYE NAME: tert-butyl 3-(acetoxymethyl)-7-(4,5-dihydro-1H-imidazol-2-ylamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 3-(acetyloxymethyl)-7-(4,5-dihydro-1H-imidazol-2-ylamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester
IUPAC NAME: tert-butyl 3-(acetyloxymethyl)-7-(4,5-dihydro-1H-imidazol-2-ylamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: tert-butyl 3-(acetyloxymethyl)-7-(4,5-dihydro-1H-imidazol-2-ylamino)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C17H24N4O5S
MOLECULAR WEIGHT: 396.46126
SMILES: CC(=O)OCC1=C(N2C(C(C2=O)NC3=NCCN3)SC1)C(=O)OC(C)(C)C
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Product OPENEYE NAME: 2-methyl-1,2,4-thiadiazolidine-5-thione
CAS Name: 2-methyl-1,2,4-thiadiazolidine-5-thione
IUPAC NAME: 2-methyl-1,2,4-thiadiazolidine-5-thione
SYSTEMATIC NAME: 2-methyl-1,2,4-thiadiazolidine-5-thione
MOLECULAR FORMULA: C3H6N2S2
MOLECULAR WEIGHT: 134.22314
SMILES: CN1CNC(=S)S1
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Product OPENEYE NAME: tert-butyl 7-isocyano-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 7-isocyano-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-isocyano-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: tert-butyl 7-isocyano-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C13H16N2O3S
MOLECULAR WEIGHT: 280.34274
SMILES: CC1=C(N2C(C(C2=O)[N+]#[C-])SC1)C(=O)OC(C)(C)C
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Product OPENEYE NAME: 7-[[5-[4-(dimethylamino)phenyl]-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-(dimethylamino)phenyl]-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-(dimethylamino)phenyl]-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-(dimethylamino)phenyl]-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: C19H23N5O3S
MOLECULAR WEIGHT: 401.48262
SMILES: CC1=C(N2C(C(C2=O)NC3=NCC(N3)C4=CC=C(C=C4)N(C)C)SC1)C(=O)O
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Product OPENEYE NAME: benzhydryl 7-formamido-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 7-formamido-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester
IUPAC NAME: benzhydryl 7-formamido-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: (diphenylmethyl) 7-formamido-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C22H20N2O4S
MOLECULAR WEIGHT: 408.4702
SMILES: CC1=C(N2C(C(C2=O)NC=O)SC1)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: tert-butyl 3-(acetoxymethyl)-7-[[6-(aminomethyl)-1H-benzimidazol-2-yl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 3-(acetyloxymethyl)-7-[[6-(aminomethyl)-1H-benzimidazol-2-yl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester
IUPAC NAME: tert-butyl 3-(acetyloxymethyl)-7-[[6-(aminomethyl)-1H-benzimidazol-2-yl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: tert-butyl 3-(acetyloxymethyl)-7-[[6-(aminomethyl)-1H-benzimidazol-2-yl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C22H27N5O5S
MOLECULAR WEIGHT: 473.54528
SMILES: CC(=O)OCC1=C(N2C(C(C2=O)NC3=NC4=C(N3)C=C(C=C4)CN)SC1)C(=O)OC(C)(C)C
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Product OPENEYE NAME: 3-aminobutan-2-one oxime
CAS Name: 3-amino-2-butanone oxime
IUPAC NAME: (NE)-N-(3-aminobutan-2-ylidene)hydroxylamine
SYSTEMATIC NAME: (NE)-N-(3-azanylbutan-2-ylidene)hydroxylamine
MOLECULAR FORMULA: C4H10N2O
MOLECULAR WEIGHT: 102.135
SMILES: CC(/C(=N/O)/C)N
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Product OPENEYE NAME: tert-butyl 7-[[5-(4-hydroxyphenyl)-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-(4-hydroxyphenyl)-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-(4-hydroxyphenyl)-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-(4-hydroxyphenyl)-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: C21H26N4O4S
MOLECULAR WEIGHT: 430.52054
SMILES: CC1=C(N2C(C(C2=O)NC3=NCC(N3)C4=CC=C(C=C4)O)SC1)C(=O)OC(C)(C)C
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Product OPENEYE NAME: benzhydryl 7-isocyano-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 7-isocyano-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester
IUPAC NAME: benzhydryl 7-isocyano-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: (diphenylmethyl) 7-isocyano-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C22H18N2O3S
MOLECULAR WEIGHT: 390.45492
SMILES: CC1=C(N2C(C(C2=O)[N+]#[C-])SC1)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: 2,2,2-trifluoroacetate hydrobromide
CAS Name: 2,2,2-trifluoroacetate hydrobromide
IUPAC NAME: 2,2,2-trifluoroacetate hydrobromide
SYSTEMATIC NAME: 2,2,2-tris(fluoranyl)ethanoate hydrobromide
MOLECULAR FORMULA: C2HBrF3O2-
MOLECULAR WEIGHT: 193.92735
SMILES: C(=O)(C(F)(F)F)[O-].Br
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Product OPENEYE NAME: 3-[[1-(carboxymethyl)tetrazol-5-yl]sulfanylmethyl]-7-(1H-imidazol-2-ylamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 3-[[[1-(carboxymethyl)-5-tetrazolyl]thio]methyl]-7-(1H-imidazol-2-ylamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 3-[[1-(carboxymethyl)tetrazol-5-yl]sulfanylmethyl]-7-(1H-imidazol-2-ylamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 3-[[1-(2-hydroxy-2-oxoethyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-7-(1H-imidazol-2-ylamino)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C14H14N8O5S2
MOLECULAR WEIGHT: 438.44156
SMILES: C1C(=C(N2C(S1)C(C2=O)NC3=NC=CN3)C(=O)O)CSC4=NN=NN4CC(=O)O
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Product OPENEYE NAME: 1-aminopropan-2-one oxime
CAS Name: 1-amino-2-propanone oxime
IUPAC NAME: (NZ)-N-(1-aminopropan-2-ylidene)hydroxylamine
SYSTEMATIC NAME: (NZ)-N-(1-azanylpropan-2-ylidene)hydroxylamine
MOLECULAR FORMULA: C3H8N2O
MOLECULAR WEIGHT: 88.10842
SMILES: C/C(=N/O)/CN
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Product OPENEYE NAME: tert-butyl 7-formamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 7-formamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester
IUPAC NAME: tert-butyl 7-formamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: tert-butyl 7-formamido-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C12H16N2O4S
MOLECULAR WEIGHT: 284.33144
SMILES: CC(C)(C)OC(=O)C1=CCSC2N1C(=O)C2NC=O
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Product OPENEYE NAME: 7-amino-3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
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
IUPAC NAME: 7-amino-3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-azanyl-3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C14H16N4O3S2
MOLECULAR WEIGHT: 352.43184
SMILES: CC1=CC(=NC(=N1)SCC2=C(N3C(C(C3=O)N)SC2)C(=O)O)C
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Product OPENEYE NAME: 1-methoxy-3-[(4-methoxyphenyl)methyl]-2H-imidazole iodide
CAS Name: 1-methoxy-3-[(4-methoxyphenyl)methyl]-2H-imidazole iodide
IUPAC NAME: 1-methoxy-3-[(4-methoxyphenyl)methyl]-2H-imidazole iodide
SYSTEMATIC NAME: 1-methoxy-3-[(4-methoxyphenyl)methyl]-2H-imidazole iodide
MOLECULAR FORMULA: C12H16IN2O2-
MOLECULAR WEIGHT: 347.17211
SMILES: COC1=CC=C(C=C1)CN2CN(C=C2)OC.[I-]
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Product OPENEYE NAME: 1-methoxy-3-[(4-methoxyphenyl)methyl]-2H-imidazole
CAS Name: 1-methoxy-3-[(4-methoxyphenyl)methyl]-2H-imidazole
IUPAC NAME: 1-methoxy-3-[(4-methoxyphenyl)methyl]-2H-imidazole
SYSTEMATIC NAME: 1-methoxy-3-[(4-methoxyphenyl)methyl]-2H-imidazole
MOLECULAR FORMULA: C12H16N2O2
MOLECULAR WEIGHT: 220.26764
SMILES: COC1=CC=C(C=C1)CN2CN(C=C2)OC
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Product OPENEYE NAME: ethyl 2-fluoro-1-trityl-imidazole-4-carboxylate
CAS Name: 2-fluoro-1-(triphenylmethyl)-4-imidazolecarboxylic acid ethyl ester
IUPAC NAME: ethyl 2-fluoro-1-tritylimidazole-4-carboxylate
SYSTEMATIC NAME: ethyl 2-fluoranyl-1-(triphenylmethyl)imidazole-4-carboxylate
MOLECULAR FORMULA: C25H21FN2O2
MOLECULAR WEIGHT: 400.444843
SMILES: CCOC(=O)C1=CN(C(=N1)F)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
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