Product OPENEYE NAME: (4Z)-4-[(2Z)-2-(3-ethylsulfanyl-6-methyl-2H-1,2,4-triazin-5-ylidene)ethylidene]-2-phenyl-oxazol-5-one
CAS Name: (4Z)-4-[(2Z)-2-[3-(ethylthio)-6-methyl-2H-1,2,4-triazin-5-ylidene]ethylidene]-2-phenyl-5-oxazolone
IUPAC NAME: (4Z)-4-[(2Z)-2-(3-ethylsulfanyl-6-methyl-2H-1,2,4-triazin-5-ylidene)ethylidene]-2-phenyl-1,3-oxazol-5-one
SYSTEMATIC NAME: (4Z)-4-[(2Z)-2-(3-ethylsulfanyl-6-methyl-2H-1,2,4-triazin-5-ylidene)ethylidene]-2-phenyl-1,3-oxazol-5-one
MOLECULAR FORMULA: C17H16N4O2S
MOLECULAR WEIGHT: 340.39954
SMILES: CCSC1=N/C(=C\C=C/2\C(=O)OC(=N2)C3=CC=CC=C3)/C(=NN1)C
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Product OPENEYE NAME: (4Z)-4-[(2Z)-2-(3-methoxy-6-methyl-2H-1,2,4-triazin-5-ylidene)ethylidene]-2-phenyl-oxazol-5-one
CAS Name: (4Z)-4-[(2Z)-2-(3-methoxy-6-methyl-2H-1,2,4-triazin-5-ylidene)ethylidene]-2-phenyl-5-oxazolone
IUPAC NAME: (4Z)-4-[(2Z)-2-(3-methoxy-6-methyl-2H-1,2,4-triazin-5-ylidene)ethylidene]-2-phenyl-1,3-oxazol-5-one
SYSTEMATIC NAME: (4Z)-4-[(2Z)-2-(3-methoxy-6-methyl-2H-1,2,4-triazin-5-ylidene)ethylidene]-2-phenyl-1,3-oxazol-5-one
MOLECULAR FORMULA: C16H14N4O3
MOLECULAR WEIGHT: 310.30736
SMILES: CC\1=NNC(=N/C1=C\C=C/2\C(=O)OC(=N2)C3=CC=CC=C3)OC
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Product OPENEYE NAME: 3-(2-pyridyl)tetrahydrothiophen-2-one
CAS Name: 3-(2-pyridinyl)-2-thiolanone
IUPAC NAME: 3-pyridin-2-ylthiolan-2-one
SYSTEMATIC NAME: 3-pyridin-2-ylthiolan-2-one
MOLECULAR FORMULA: C9H9NOS
MOLECULAR WEIGHT: 179.23886
SMILES: C1CSC(=O)C1C2=CC=CC=N2
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Product OPENEYE NAME: 3-(3-pyridyl)tetrahydrothiophen-2-one
CAS Name: 3-(3-pyridinyl)-2-thiolanone
IUPAC NAME: 3-pyridin-3-ylthiolan-2-one
SYSTEMATIC NAME: 3-pyridin-3-ylthiolan-2-one
MOLECULAR FORMULA: C9H9NOS
MOLECULAR WEIGHT: 179.23886
SMILES: C1CSC(=O)C1C2=CN=CC=C2
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Product OPENEYE NAME: 3-(4-pyridyl)tetrahydrothiophen-2-one
CAS Name: 3-pyridin-4-yl-2-thiolanone
IUPAC NAME: 3-pyridin-4-ylthiolan-2-one
SYSTEMATIC NAME: 3-pyridin-4-ylthiolan-2-one
MOLECULAR FORMULA: C9H9NOS
MOLECULAR WEIGHT: 179.23886
SMILES: C1CSC(=O)C1C2=CC=NC=C2
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Product OPENEYE NAME: (3E)-3-[[2-(3-chlorophenyl)hydrazino]methylene]quinoxalin-2-one
CAS Name: (3E)-3-[[(3-chlorophenyl)hydrazo]methylidene]-2-quinoxalinone
IUPAC NAME: (3E)-3-[[2-(3-chlorophenyl)hydrazinyl]methylidene]quinoxalin-2-one
SYSTEMATIC NAME: (3E)-3-[[2-(3-chlorophenyl)hydrazinyl]methylidene]quinoxalin-2-one
MOLECULAR FORMULA: C15H11ClN4O
MOLECULAR WEIGHT: 298.72704
SMILES: C1=CC2=N/C(=C/NNC3=CC(=CC=C3)Cl)/C(=O)N=C2C=C1
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Product OPENEYE NAME: 1-deuterio-5-methyl-3-phenyl-pyrazole
CAS Name: 1-deuterio-5-methyl-3-phenylpyrazole
IUPAC NAME: 1-deuterio-5-methyl-3-phenylpyrazole
SYSTEMATIC NAME: 1-deuterio-5-methyl-3-phenyl-pyrazole
MOLECULAR FORMULA: C10H10N2
MOLECULAR WEIGHT: 159.205962
SMILES: [2H]N1C(=CC(=N1)C2=CC=CC=C2)C
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Product OPENEYE NAME: 1-deuterio-3,5-diphenyl-pyrazole
CAS Name: 1-deuterio-3,5-diphenylpyrazole
IUPAC NAME: 1-deuterio-3,5-diphenylpyrazole
SYSTEMATIC NAME: 1-deuterio-3,5-diphenyl-pyrazole
MOLECULAR FORMULA: C15H12N2
MOLECULAR WEIGHT: 221.275342
SMILES: [2H]N1C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: [5-(4-acetyl-5-methyl-triazol-1-yl)imidazol-4-ylidene]methyleneazanide
CAS Name: [5-(4-acetyl-5-methyl-1-triazolyl)-4-imidazolylidene]methylideneazanide
IUPAC NAME: [5-(4-acetyl-5-methyltriazol-1-yl)imidazol-4-ylidene]methylideneazanide
SYSTEMATIC NAME: [5-(4-ethanoyl-5-methyl-1,2,3-triazol-1-yl)imidazol-4-ylidene]methylideneazanide
MOLECULAR FORMULA: C9H7N6O-
MOLECULAR WEIGHT: 215.19148
SMILES: CC1=C(N=NN1C2=NC=NC2=C=[N-])C(=O)C
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Product OPENEYE NAME: [5-(4-benzoyl-5-methyl-triazol-1-yl)imidazol-4-ylidene]methyleneazanide
CAS Name: [5-(4-benzoyl-5-methyl-1-triazolyl)-4-imidazolylidene]methylideneazanide
IUPAC NAME: [5-(4-benzoyl-5-methyltriazol-1-yl)imidazol-4-ylidene]methylideneazanide
SYSTEMATIC NAME: [5-[5-methyl-4-(phenylcarbonyl)-1,2,3-triazol-1-yl]imidazol-4-ylidene]methylideneazanide
MOLECULAR FORMULA: C14H9N6O-
MOLECULAR WEIGHT: 277.26086
SMILES: CC1=C(N=NN1C2=NC=NC2=C=[N-])C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: [5-(4-acetyl-5-phenyl-triazol-1-yl)imidazol-4-ylidene]methyleneazanide
CAS Name: [5-(4-acetyl-5-phenyl-1-triazolyl)-4-imidazolylidene]methylideneazanide
IUPAC NAME: [5-(4-acetyl-5-phenyltriazol-1-yl)imidazol-4-ylidene]methylideneazanide
SYSTEMATIC NAME: [5-(4-ethanoyl-5-phenyl-1,2,3-triazol-1-yl)imidazol-4-ylidene]methylideneazanide
MOLECULAR FORMULA: C14H9N6O-
MOLECULAR WEIGHT: 277.26086
SMILES: CC(=O)C1=C(N(N=N1)C2=NC=NC2=C=[N-])C3=CC=CC=C3
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Product OPENEYE NAME: 1-[1-[5-(iminomethylene)imidazol-4-yl]-5-phenyl-triazol-4-yl]ethanone
CAS Name: 1-[1-[5-(iminomethylidene)-4-imidazolyl]-5-phenyl-4-triazolyl]ethanone
IUPAC NAME: 1-[1-[5-(iminomethylidene)imidazol-4-yl]-5-phenyltriazol-4-yl]ethanone
SYSTEMATIC NAME: 1-[1-[5-(azanylidenemethylidene)imidazol-4-yl]-5-phenyl-1,2,3-triazol-4-yl]ethanone
MOLECULAR FORMULA: C14H10N6O
MOLECULAR WEIGHT: 278.2688
SMILES: CC(=O)C1=C(N(N=N1)C2=NC=NC2=C=N)C3=CC=CC=C3
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Product OPENEYE NAME: [5-(4-ethoxycarbonyl-5-methyl-triazol-1-yl)imidazol-4-ylidene]methyleneazanide
CAS Name: [5-(4-ethoxycarbonyl-5-methyl-1-triazolyl)-4-imidazolylidene]methylideneazanide
IUPAC NAME: [5-(4-ethoxycarbonyl-5-methyltriazol-1-yl)imidazol-4-ylidene]methylideneazanide
SYSTEMATIC NAME: [5-(4-ethoxycarbonyl-5-methyl-1,2,3-triazol-1-yl)imidazol-4-ylidene]methylideneazanide
MOLECULAR FORMULA: C10H9N6O2-
MOLECULAR WEIGHT: 245.21746
SMILES: CCOC(=O)C1=C(N(N=N1)C2=NC=NC2=C=[N-])C
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Product OPENEYE NAME: (4-acetyl-5-methyl-imidazo[5,1-d][1,2,3,5]tetrazepin-9-ylidene)methyleneazanide
CAS Name: (4-acetyl-5-methyl-9-imidazo[5,1-d][1,2,3,5]tetrazepinylidene)methylideneazanide
IUPAC NAME: (4-acetyl-5-methylimidazo[5,1-d][1,2,3,5]tetrazepin-9-ylidene)methylideneazanide
SYSTEMATIC NAME: (4-ethanoyl-5-methyl-imidazo[5,1-d][1,2,3,5]tetrazepin-9-ylidene)methylideneazanide
MOLECULAR FORMULA: C9H7N6O-
MOLECULAR WEIGHT: 215.19148
SMILES: CC1=C(N=NN=C2N1C=NC2=C=[N-])C(=O)C
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Product OPENEYE NAME: (4-benzoyl-5-methyl-imidazo[5,1-d][1,2,3,5]tetrazepin-9-ylidene)methyleneazanide
CAS Name: (4-benzoyl-5-methyl-9-imidazo[5,1-d][1,2,3,5]tetrazepinylidene)methylideneazanide
IUPAC NAME: (4-benzoyl-5-methylimidazo[5,1-d][1,2,3,5]tetrazepin-9-ylidene)methylideneazanide
SYSTEMATIC NAME: [5-methyl-4-(phenylcarbonyl)imidazo[5,1-d][1,2,3,5]tetrazepin-9-ylidene]methylideneazanide
MOLECULAR FORMULA: C14H9N6O-
MOLECULAR WEIGHT: 277.26086
SMILES: CC1=C(N=NN=C2N1C=NC2=C=[N-])C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: (4-ethoxycarbonyl-5-methyl-imidazo[5,1-d][1,2,3,5]tetrazepin-9-ylidene)methyleneazanide
CAS Name: (4-ethoxycarbonyl-5-methyl-9-imidazo[5,1-d][1,2,3,5]tetrazepinylidene)methylideneazanide
IUPAC NAME: (4-ethoxycarbonyl-5-methylimidazo[5,1-d][1,2,3,5]tetrazepin-9-ylidene)methylideneazanide
SYSTEMATIC NAME: (4-ethoxycarbonyl-5-methyl-imidazo[5,1-d][1,2,3,5]tetrazepin-9-ylidene)methylideneazanide
MOLECULAR FORMULA: C10H9N6O2-
MOLECULAR WEIGHT: 245.21746
SMILES: CCOC(=O)C1=C(N2C=NC(=C=[N-])C2=NN=N1)C
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Product OPENEYE NAME: (5-amino-4-cyano-imidazo[5,1-d][1,2,3,5]tetrazepin-9-ylidene)methyleneazanide
CAS Name: (5-amino-4-cyano-9-imidazo[5,1-d][1,2,3,5]tetrazepinylidene)methylideneazanide
IUPAC NAME: (5-amino-4-cyanoimidazo[5,1-d][1,2,3,5]tetrazepin-9-ylidene)methylideneazanide
SYSTEMATIC NAME: (5-azanyl-4-cyano-imidazo[5,1-d][1,2,3,5]tetrazepin-9-ylidene)methylideneazanide
MOLECULAR FORMULA: C7H3N8-
MOLECULAR WEIGHT: 199.15232
SMILES: C1=NC(=C=[N-])C2=NN=NC(=C(N21)N)C#N
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Product OPENEYE NAME: 2-cyano-2-dioxidoiminio-acetate
CAS Name: 2-cyano-2-dioxidoiminioacetate
IUPAC NAME: 2-cyano-2-dioxidoazaniumylideneacetate
SYSTEMATIC NAME: 2-bis(oxidanidyl)azaniumylidene-2-cyano-ethanoate
MOLECULAR FORMULA: C3N2O4-2
MOLECULAR WEIGHT: 128.0431
SMILES: C(#N)/C(=[N+](\[O-])/[O-])/C(=O)[O-]
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Product OPENEYE NAME: 2-cyano-2-nitro-acetic acid
CAS Name: 2-cyano-2-nitroacetic acid
IUPAC NAME: 2-cyano-2-nitroacetic acid
SYSTEMATIC NAME: 2-cyano-2-nitro-ethanoic acid
MOLECULAR FORMULA: C3H2N2O4
MOLECULAR WEIGHT: 130.05898
SMILES: C(#N)C(C(=O)O)[N+](=O)[O-]
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Product OPENEYE NAME: cyanomethylene(dioxido)ammonium
CAS Name: cyanomethylidene(dioxido)ammonium
IUPAC NAME: cyanomethylidene(dioxido)azanium
SYSTEMATIC NAME: cyanomethylidene-bis(oxidanidyl)azanium
MOLECULAR FORMULA: C2HN2O2-
MOLECULAR WEIGHT: 85.04154
SMILES: C(=[N+](\[O-])/[O-])\C#N
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Product OPENEYE NAME: 2,6,6-trimethyl-1-(p-tolyl)-5,7-dihydroindol-4-one oxime
CAS Name: 2,6,6-trimethyl-1-(4-methylphenyl)-5,7-dihydroindol-4-one oxime
IUPAC NAME: (NZ)-N-[2,6,6-trimethyl-1-(4-methylphenyl)-5,7-dihydroindol-4-ylidene]hydroxylamine
SYSTEMATIC NAME: (NZ)-N-[2,6,6-trimethyl-1-(4-methylphenyl)-5,7-dihydroindol-4-ylidene]hydroxylamine
MOLECULAR FORMULA: C18H22N2O
MOLECULAR WEIGHT: 282.38008
SMILES: CC1=CC=C(C=C1)N2C(=CC\3=C2CC(C/C3=N/O)(C)C)C
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Product OPENEYE NAME: 1-(4-methoxyphenyl)-2,6,6-trimethyl-5,7-dihydroindol-4-one oxime
CAS Name: 1-(4-methoxyphenyl)-2,6,6-trimethyl-5,7-dihydroindol-4-one oxime
IUPAC NAME: (NZ)-N-[1-(4-methoxyphenyl)-2,6,6-trimethyl-5,7-dihydroindol-4-ylidene]hydroxylamine
SYSTEMATIC NAME: (NZ)-N-[1-(4-methoxyphenyl)-2,6,6-trimethyl-5,7-dihydroindol-4-ylidene]hydroxylamine
MOLECULAR FORMULA: C18H22N2O2
MOLECULAR WEIGHT: 298.37948
SMILES: CC1=CC\2=C(N1C3=CC=C(C=C3)OC)CC(C/C2=N/O)(C)C
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Product OPENEYE NAME: 1-(4-bromophenyl)-2,6,6-trimethyl-5,7-dihydroindol-4-one oxime
CAS Name: 1-(4-bromophenyl)-2,6,6-trimethyl-5,7-dihydroindol-4-one oxime
IUPAC NAME: (NZ)-N-[1-(4-bromophenyl)-2,6,6-trimethyl-5,7-dihydroindol-4-ylidene]hydroxylamine
SYSTEMATIC NAME: (NZ)-N-[1-(4-bromophenyl)-2,6,6-trimethyl-5,7-dihydroindol-4-ylidene]hydroxylamine
MOLECULAR FORMULA: C17H19BrN2O
MOLECULAR WEIGHT: 347.24956
SMILES: CC1=CC\2=C(N1C3=CC=C(C=C3)Br)CC(C/C2=N/O)(C)C
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Product OPENEYE NAME: 1-(2-chlorophenyl)-2,6,6-trimethyl-5,7-dihydroindol-4-one oxime
CAS Name: 1-(2-chlorophenyl)-2,6,6-trimethyl-5,7-dihydroindol-4-one oxime
IUPAC NAME: (NZ)-N-[1-(2-chlorophenyl)-2,6,6-trimethyl-5,7-dihydroindol-4-ylidene]hydroxylamine
SYSTEMATIC NAME: (NZ)-N-[1-(2-chlorophenyl)-2,6,6-trimethyl-5,7-dihydroindol-4-ylidene]hydroxylamine
MOLECULAR FORMULA: C17H19ClN2O
MOLECULAR WEIGHT: 302.79856
SMILES: CC1=CC\2=C(N1C3=CC=CC=C3Cl)CC(C/C2=N/O)(C)C
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