Product OPENEYE NAME: 5-acetamido-4-nitro-isothiazole-3-carboxylic acid
CAS Name: 5-acetamido-4-nitro-3-isothiazolecarboxylic acid
IUPAC NAME: 5-acetamido-4-nitro-1,2-thiazole-3-carboxylic acid
SYSTEMATIC NAME: 5-acetamido-4-nitro-1,2-thiazole-3-carboxylic acid
MOLECULAR FORMULA: C6H5N3O5S
MOLECULAR WEIGHT: 231.186
SMILES: CC(=O)NC1=C(C(=NS1)C(=O)O)[N+](=O)[O-]
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Product OPENEYE NAME: 3-methylisothiazole-4,5-diamine
CAS Name: 3-methylisothiazole-4,5-diamine
IUPAC NAME: 3-methyl-1,2-thiazole-4,5-diamine
SYSTEMATIC NAME: 3-methyl-1,2-thiazole-4,5-diamine
MOLECULAR FORMULA: C4H7N3S
MOLECULAR WEIGHT: 129.18348
SMILES: CC1=NSC(=C1N)N
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MOLECULAR FORMULA: C8H9NO2
MOLECULAR WEIGHT: 151.16256
SMILES: [C@@H]12C3[C@@H](C1C(=O)O)C4C3C2N4
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MOLECULAR FORMULA: C8H8ClNO
MOLECULAR WEIGHT: 169.60822
SMILES: [C@@H]12[C@H]3[C@H]([C@@H]1C4C2C3C(=O)N4)Cl
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MOLECULAR FORMULA: C14H12BrNO4S
MOLECULAR WEIGHT: 370.21838
SMILES: C1=CC(=CC=C1S(=O)(=O)OC(=O)C2[C@H]3C4[C@@H]2C5C4C3N5)Br
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Product OPENEYE NAME: [5-[(3-benzyloxyphenyl)methyl]-2,6-bis(trimethylsilyloxy)pyrimidin-4-yl]oxy-trimethyl-silane
CAS Name: trimethyl-[[5-[(3-phenylmethoxyphenyl)methyl]-2,6-bis(trimethylsilyloxy)-4-pyrimidinyl]oxy]silane
IUPAC NAME: trimethyl-[5-[(3-phenylmethoxyphenyl)methyl]-2,6-bis(trimethylsilyloxy)pyrimidin-4-yl]oxysilane
SYSTEMATIC NAME: trimethyl-[5-[(3-phenylmethoxyphenyl)methyl]-2,6-bis(trimethylsilyloxy)pyrimidin-4-yl]oxy-silane
MOLECULAR FORMULA: C27H40N2O4Si3
MOLECULAR WEIGHT: 540.874
SMILES: C[Si](C)(C)OC1=C(C(=NC(=N1)O[Si](C)(C)C)O[Si](C)(C)C)CC2=CC(=CC=C2)OCC3=CC=CC=C3
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Product OPENEYE NAME: [1-[2-(4-bromophenyl)-2-oxo-ethyl]-1,2,4-triazol-1-ium-4-yl]-(p-tolylsulfonyl)azanide
CAS Name: [1-[2-(4-bromophenyl)-2-oxoethyl]-1,2,4-triazol-1-ium-4-yl]-(4-methylphenyl)sulfonylazanide
IUPAC NAME: [1-[2-(4-bromophenyl)-2-oxoethyl]-1,2,4-triazol-1-ium-4-yl]-(4-methylphenyl)sulfonylazanide
SYSTEMATIC NAME: [1-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-1,2,4-triazol-1-ium-4-yl]-(4-methylphenyl)sulfonyl-azanide
MOLECULAR FORMULA: C17H15BrN4O3S
MOLECULAR WEIGHT: 435.295
SMILES: CC1=CC=C(C=C1)S(=O)(=O)[N-]N2C=N[N+](=C2)CC(=O)C3=CC=C(C=C3)Br
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Product OPENEYE NAME: [1-[2-(4-chlorophenyl)-2-oxo-ethyl]-1,2,4-triazol-1-ium-4-yl]-(p-tolylsulfonyl)azanide
CAS Name: [1-[2-(4-chlorophenyl)-2-oxoethyl]-1,2,4-triazol-1-ium-4-yl]-(4-methylphenyl)sulfonylazanide
IUPAC NAME: [1-[2-(4-chlorophenyl)-2-oxoethyl]-1,2,4-triazol-1-ium-4-yl]-(4-methylphenyl)sulfonylazanide
SYSTEMATIC NAME: [1-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-1,2,4-triazol-1-ium-4-yl]-(4-methylphenyl)sulfonyl-azanide
MOLECULAR FORMULA: C17H15ClN4O3S
MOLECULAR WEIGHT: 390.844
SMILES: CC1=CC=C(C=C1)S(=O)(=O)[N-]N2C=N[N+](=C2)CC(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 3-(2-hydroxyethyl)-2-[(Z)-(phenylhydrazono)methyl]quinazolin-4-one
CAS Name: 3-(2-hydroxyethyl)-2-[(Z)-(phenylhydrazinylidene)methyl]-4-quinazolinone
IUPAC NAME: 3-(2-hydroxyethyl)-2-[(Z)-(phenylhydrazinylidene)methyl]quinazolin-4-one
SYSTEMATIC NAME: 3-(2-hydroxyethyl)-2-[(Z)-(phenylhydrazinylidene)methyl]quinazolin-4-one
MOLECULAR FORMULA: C17H16N4O2
MOLECULAR WEIGHT: 308.33454
SMILES: C1=CC=C(C=C1)N/N=C\C2=NC3=CC=CC=C3C(=O)N2CCO
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MOLECULAR FORMULA: C58H61N3O11S
MOLECULAR WEIGHT: 1008.18344
SMILES: CCN(CC)S1(O[C@H]2[C@@H]([C@H](O[C@H]2N3C=CC(=O)N=C3/C=C(\O1)/C)COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)OC(C7=CC=CC=C7)(C8=CC=C(C=C8)OC)C9=CC=C(C=C9)OC)O
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MOLECULAR FORMULA: C21H38N2O4Si2
MOLECULAR WEIGHT: 438.70842
SMILES: CC(C)(C)[Si](C)(C)[C@@H]1[C@@H]([C@H]2COC3=NC(=O)C=CN3[C@@H]1O2)O[Si](C)(C)C(C)(C)C
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Product OPENEYE NAME: [(2R,3R,4R,5R)-3,4-dibenzoyloxy-5-(4-oxo-2-phenacylsulfanyl-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl benzoate
CAS Name: benzoic acid [(2R,3R,4R,5R)-3,4-dibenzoyloxy-5-[4-oxo-2-(phenacylthio)-1-pyrimidinyl]-2-oxolanyl]methyl ester
IUPAC NAME: [(2R,3R,4R,5R)-3,4-dibenzoyloxy-5-(4-oxo-2-phenacylsulfanylpyrimidin-1-yl)oxolan-2-yl]methyl benzoate
SYSTEMATIC NAME: [(2R,3R,4R,5R)-5-(4-oxidanylidene-2-phenacylsulfanyl-pyrimidin-1-yl)-3,4-bis(phenylcarbonyloxy)oxolan-2-yl]methyl benzoate
MOLECULAR FORMULA: C38H30N2O9S
MOLECULAR WEIGHT: 690.7178
SMILES: C1=CC=C(C=C1)C(=O)CSC2=NC(=O)C=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)COC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6
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Product OPENEYE NAME: ethyl 4-[(4Z)-3-(dicyanomethylene)-4-(dimethylaminomethylene)pyrrolidin-1-yl]benzoate
CAS Name: 4-[(4Z)-3-(dicyanomethylidene)-4-(dimethylaminomethylidene)-1-pyrrolidinyl]benzoic acid ethyl ester
IUPAC NAME: ethyl 4-[(4Z)-3-(dicyanomethylidene)-4-(dimethylaminomethylidene)pyrrolidin-1-yl]benzoate
SYSTEMATIC NAME: ethyl 4-[(4Z)-3-(dicyanomethylidene)-4-(dimethylaminomethylidene)pyrrolidin-1-yl]benzoate
MOLECULAR FORMULA: C19H20N4O2
MOLECULAR WEIGHT: 336.3877
SMILES: CCOC(=O)C1=CC=C(C=C1)N2C/C(=C\N(C)C)/C(=C(C#N)C#N)C2
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Product OPENEYE NAME: tert-butyl 4-[(4Z)-3-(dicyanomethylene)-4-(dimethylaminomethylene)pyrrolidin-1-yl]benzoate
CAS Name: 4-[(4Z)-3-(dicyanomethylidene)-4-(dimethylaminomethylidene)-1-pyrrolidinyl]benzoic acid tert-butyl ester
IUPAC NAME: tert-butyl 4-[(4Z)-3-(dicyanomethylidene)-4-(dimethylaminomethylidene)pyrrolidin-1-yl]benzoate
SYSTEMATIC NAME: tert-butyl 4-[(4Z)-3-(dicyanomethylidene)-4-(dimethylaminomethylidene)pyrrolidin-1-yl]benzoate
MOLECULAR FORMULA: C21H24N4O2
MOLECULAR WEIGHT: 364.44086
SMILES: CC(C)(C)OC(=O)C1=CC=C(C=C1)N2C/C(=C\N(C)C)/C(=C(C#N)C#N)C2
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Product OPENEYE NAME: 1-[(2R,4S,5S)-4-azido-5-[[tert-butyl(diphenyl)silyl]oxymethyl]tetrahydrofuran-2-yl]pyrazolo[3,4-d]pyrimidin-4-amine
CAS Name: 1-[(2R,4S,5S)-4-azido-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-oxolanyl]-4-pyrazolo[3,4-d]pyrimidinamine
IUPAC NAME: 1-[(2R,4S,5S)-4-azido-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolan-2-yl]pyrazolo[3,4-d]pyrimidin-4-amine
SYSTEMATIC NAME: 1-[(2R,4S,5S)-4-azido-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolan-2-yl]pyrazolo[3,4-d]pyrimidin-4-amine
MOLECULAR FORMULA: C26H30N8O2Si
MOLECULAR WEIGHT: 514.6543
SMILES: CC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OC[C@@H]3[C@H](C[C@@H](O3)N4C5=C(C=N4)C(=NC=N5)N)N=[N+]=[N-]
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Product OPENEYE NAME: 1-[(2S,4S,5S)-4-azido-5-[[tert-butyl(diphenyl)silyl]oxymethyl]tetrahydrofuran-2-yl]-2H-pyrazolo[3,4-d]pyrimidin-4-one
CAS Name: 1-[(2S,4S,5S)-4-azido-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-oxolanyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one
IUPAC NAME: 1-[(2S,4S,5S)-4-azido-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolan-2-yl]-2H-pyrazolo[3,4-d]pyrimidin-4-one
SYSTEMATIC NAME: 1-[(2S,4S,5S)-4-azido-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolan-2-yl]-2H-pyrazolo[3,4-d]pyrimidin-4-one
MOLECULAR FORMULA: C26H29N7O3Si
MOLECULAR WEIGHT: 515.63906
SMILES: CC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OC[C@@H]3[C@H](C[C@H](O3)N4C5=NC=NC(=O)C5=CN4)N=[N+]=[N-]
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Product OPENEYE NAME: 2-(7-chlorotetrazolo[1,5-a]quinoxalin-4-yl)-N-(2-pyridyl)acetamide
CAS Name: 2-(7-chloro-4-tetrazolo[1,5-a]quinoxalinyl)-N-(2-pyridinyl)acetamide
IUPAC NAME: 2-(7-chlorotetrazolo[1,5-a]quinoxalin-4-yl)-N-pyridin-2-ylacetamide
SYSTEMATIC NAME: 2-(7-chloranyl-[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-yl)-N-pyridin-2-yl-ethanamide
MOLECULAR FORMULA: C15H10ClN7O
MOLECULAR WEIGHT: 339.7392
SMILES: C1=CC=NC(=C1)NC(=O)CC2=NC3=C(C=CC(=C3)Cl)N4C2=NN=N4
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Product OPENEYE NAME: 2-(7-chlorotetrazolo[1,5-a]quinoxalin-4-yl)-N-(3-pyridyl)acetamide
CAS Name: 2-(7-chloro-4-tetrazolo[1,5-a]quinoxalinyl)-N-(3-pyridinyl)acetamide
IUPAC NAME: 2-(7-chlorotetrazolo[1,5-a]quinoxalin-4-yl)-N-pyridin-3-ylacetamide
SYSTEMATIC NAME: 2-(7-chloranyl-[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-yl)-N-pyridin-3-yl-ethanamide
MOLECULAR FORMULA: C15H10ClN7O
MOLECULAR WEIGHT: 339.7392
SMILES: C1=CC(=CN=C1)NC(=O)CC2=NC3=C(C=CC(=C3)Cl)N4C2=NN=N4
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