Product OPENEYE NAME: 3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
CAS Name: 3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
IUPAC NAME: 3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
SYSTEMATIC NAME: 3-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
MOLECULAR FORMULA: C16H16N4O5
MOLECULAR WEIGHT: 344.32204
SMILES: C1=CC=C(C=C1)C2=CC(=O)N3C(=N2)N(C=N3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O
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Product OPENEYE NAME: 3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-one
CAS Name: 3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-one
IUPAC NAME: 3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-one
SYSTEMATIC NAME: 3-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-one
MOLECULAR FORMULA: C14H18N4O5
MOLECULAR WEIGHT: 322.31652
SMILES: C1CCC2=C(C1)C(=O)N3C(=N2)N(C=N3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O
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Product OPENEYE NAME: 6-(trifluoromethyl)pyrimido[1,2-b][1,2,4]triazin-8-one
CAS Name: 6-(trifluoromethyl)-8-pyrimido[1,2-b][1,2,4]triazinone
IUPAC NAME: 6-(trifluoromethyl)pyrimido[1,2-b][1,2,4]triazin-8-one
SYSTEMATIC NAME: 6-(trifluoromethyl)pyrimido[1,2-b][1,2,4]triazin-8-one
MOLECULAR FORMULA: C7H3F3N4O
MOLECULAR WEIGHT: 216.12013
SMILES: C1=NC2=NC(=CC(=O)N2N=C1)C(F)(F)F
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Product OPENEYE NAME: 2,3-dimethyl-6-(trifluoromethyl)pyrimido[1,2-b][1,2,4]triazin-8-one
CAS Name: 2,3-dimethyl-6-(trifluoromethyl)-8-pyrimido[1,2-b][1,2,4]triazinone
IUPAC NAME: 2,3-dimethyl-6-(trifluoromethyl)pyrimido[1,2-b][1,2,4]triazin-8-one
SYSTEMATIC NAME: 2,3-dimethyl-6-(trifluoromethyl)pyrimido[1,2-b][1,2,4]triazin-8-one
MOLECULAR FORMULA: C9H7F3N4O
MOLECULAR WEIGHT: 244.17329
SMILES: CC1=NC2=NC(=CC(=O)N2N=C1C)C(F)(F)F
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Product OPENEYE NAME: 7-chloro-6-(trifluoromethyl)pyrimido[1,2-b][1,2,4]triazin-8-one
CAS Name: 7-chloro-6-(trifluoromethyl)-8-pyrimido[1,2-b][1,2,4]triazinone
IUPAC NAME: 7-chloro-6-(trifluoromethyl)pyrimido[1,2-b][1,2,4]triazin-8-one
SYSTEMATIC NAME: 7-chloranyl-6-(trifluoromethyl)pyrimido[1,2-b][1,2,4]triazin-8-one
MOLECULAR FORMULA: C7H2ClF3N4O
MOLECULAR WEIGHT: 250.56519
SMILES: C1=NC2=NC(=C(C(=O)N2N=C1)Cl)C(F)(F)F
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Product OPENEYE NAME: 2-(trifluoromethyl)-1,7,8,9-tetrahydropyrimido[1,2-b][1,2,4]benzotriazin-4-one
CAS Name: 2-(trifluoromethyl)-1,7,8,9-tetrahydropyrimido[1,2-b][1,2,4]benzotriazin-4-one
IUPAC NAME: 2-(trifluoromethyl)-1,7,8,9-tetrahydropyrimido[1,2-b][1,2,4]benzotriazin-4-one
SYSTEMATIC NAME: 2-(trifluoromethyl)-1,7,8,9-tetrahydropyrimido[1,2-b][1,2,4]benzotriazin-4-one
MOLECULAR FORMULA: C11H9F3N4O
MOLECULAR WEIGHT: 270.21057
SMILES: C1CC=C2C(=NN3C(=O)C=C(NC3=N2)C(F)(F)F)C1
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Product OPENEYE NAME: 3-chloro-2-(trifluoromethyl)-1,7,8,9-tetrahydropyrimido[1,2-b][1,2,4]benzotriazin-4-one
CAS Name: 3-chloro-2-(trifluoromethyl)-1,7,8,9-tetrahydropyrimido[1,2-b][1,2,4]benzotriazin-4-one
IUPAC NAME: 3-chloro-2-(trifluoromethyl)-1,7,8,9-tetrahydropyrimido[1,2-b][1,2,4]benzotriazin-4-one
SYSTEMATIC NAME: 3-chloranyl-2-(trifluoromethyl)-1,7,8,9-tetrahydropyrimido[1,2-b][1,2,4]benzotriazin-4-one
MOLECULAR FORMULA: C11H8ClF3N4O
MOLECULAR WEIGHT: 304.65563
SMILES: C1CC=C2C(=NN3C(=O)C(=C(NC3=N2)C(F)(F)F)Cl)C1
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Product OPENEYE NAME: 3-bromo-2-(trifluoromethyl)-1,7,8,9-tetrahydropyrimido[1,2-b][1,2,4]benzotriazin-4-one
CAS Name: 3-bromo-2-(trifluoromethyl)-1,7,8,9-tetrahydropyrimido[1,2-b][1,2,4]benzotriazin-4-one
IUPAC NAME: 3-bromo-2-(trifluoromethyl)-1,7,8,9-tetrahydropyrimido[1,2-b][1,2,4]benzotriazin-4-one
SYSTEMATIC NAME: 3-bromanyl-2-(trifluoromethyl)-1,7,8,9-tetrahydropyrimido[1,2-b][1,2,4]benzotriazin-4-one
MOLECULAR FORMULA: C11H8BrF3N4O
MOLECULAR WEIGHT: 349.10663
SMILES: C1CC=C2C(=NN3C(=O)C(=C(NC3=N2)C(F)(F)F)Br)C1
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
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MOLECULAR FORMULA: C17H7F3N4O
MOLECULAR WEIGHT: 340.25889
SMILES: C1=CC2=C3C(=C1)C4=NC5=NC(=CC(=O)N5N=C4C3=CC=C2)C(F)(F)F
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H9F3N4O
MOLECULAR WEIGHT: 366.29617
SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3C4=NN5C(=O)C=C(N=C5N=C24)C(F)(F)F
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Product OPENEYE NAME: benzyl (3E)-3-[(3-nitro-2-pyridyl)hydrazono]propanoate
CAS Name: (3E)-3-[(3-nitro-2-pyridinyl)hydrazinylidene]propanoic acid (phenylmethyl) ester
IUPAC NAME: benzyl (3E)-3-[(3-nitropyridin-2-yl)hydrazinylidene]propanoate
SYSTEMATIC NAME: (phenylmethyl) (3E)-3-[(3-nitropyridin-2-yl)hydrazinylidene]propanoate
MOLECULAR FORMULA: C15H14N4O4
MOLECULAR WEIGHT: 314.29606
SMILES: C1=CC=C(C=C1)COC(=O)C/C=N/NC2=C(C=CC=N2)[N+](=O)[O-]
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Product OPENEYE NAME: ethyl (3Z)-3-(4-nitrophenyl)-3-[(3-nitro-2-pyridyl)hydrazono]propanoate
CAS Name: (3Z)-3-(4-nitrophenyl)-3-[(3-nitro-2-pyridinyl)hydrazinylidene]propanoic acid ethyl ester
IUPAC NAME: ethyl (3Z)-3-(4-nitrophenyl)-3-[(3-nitropyridin-2-yl)hydrazinylidene]propanoate
SYSTEMATIC NAME: ethyl (3Z)-3-(4-nitrophenyl)-3-[(3-nitropyridin-2-yl)hydrazinylidene]propanoate
MOLECULAR FORMULA: C16H15N5O6
MOLECULAR WEIGHT: 373.3202
SMILES: CCOC(=O)C/C(=N/NC1=C(C=CC=N1)[N+](=O)[O-])/C2=CC=C(C=C2)[N+](=O)[O-]
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Product OPENEYE NAME: ethyl (E)-3-(4-nitrophenyl)-3-[(3-nitro-2-pyridyl)azo]prop-2-enoate
CAS Name: (E)-3-(4-nitrophenyl)-3-[(3-nitro-2-pyridinyl)azo]-2-propenoic acid ethyl ester
IUPAC NAME: ethyl (E)-3-(4-nitrophenyl)-3-[(3-nitropyridin-2-yl)diazenyl]prop-2-enoate
SYSTEMATIC NAME: ethyl (E)-3-(4-nitrophenyl)-3-[(3-nitropyridin-2-yl)diazenyl]prop-2-enoate
MOLECULAR FORMULA: C16H13N5O6
MOLECULAR WEIGHT: 371.30432
SMILES: CCOC(=O)/C=C(\C1=CC=C(C=C1)[N+](=O)[O-])/N=NC2=C(C=CC=N2)[N+](=O)[O-]
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Product OPENEYE NAME: 4-chlorothieno[3,2-b][1,5]benzoxazepine
CAS Name: 4-chlorothieno[3,2-b][1,5]benzoxazepine
IUPAC NAME: 4-chlorothieno[3,2-b][1,5]benzoxazepine
SYSTEMATIC NAME: 4-chloranylthieno[3,2-b][1,5]benzoxazepine
MOLECULAR FORMULA: C11H6ClNOS
MOLECULAR WEIGHT: 235.68944
SMILES: C1=CC=C2C(=C1)N=C(C3=C(O2)C=CS3)Cl
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Product OPENEYE NAME: 4,7-dichlorothieno[3,2-b][1,5]benzoxazepine
CAS Name: 4,7-dichlorothieno[3,2-b][1,5]benzoxazepine
IUPAC NAME: 4,7-dichlorothieno[3,2-b][1,5]benzoxazepine
SYSTEMATIC NAME: 4,7-bis(chloranyl)thieno[3,2-b][1,5]benzoxazepine
MOLECULAR FORMULA: C11H5Cl2NOS
MOLECULAR WEIGHT: 270.1345
SMILES: C1=CC2=C(C=C1Cl)N=C(C3=C(O2)C=CS3)Cl
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Product OPENEYE NAME: 4,9-dichlorothieno[3,2-b][1,5]benzoxazepine
CAS Name: 4,9-dichlorothieno[3,2-b][1,5]benzoxazepine
IUPAC NAME: 4,9-dichlorothieno[3,2-b][1,5]benzoxazepine
SYSTEMATIC NAME: 4,9-bis(chloranyl)thieno[3,2-b][1,5]benzoxazepine
MOLECULAR FORMULA: C11H5Cl2NOS
MOLECULAR WEIGHT: 270.1345
SMILES: C1=CC2=C(C(=C1)Cl)OC3=C(C(=N2)Cl)SC=C3
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Product OPENEYE NAME: 4-chloro-7-(trifluoromethyl)thieno[3,2-b][1,5]benzoxazepine
CAS Name: 4-chloro-7-(trifluoromethyl)thieno[3,2-b][1,5]benzoxazepine
IUPAC NAME: 4-chloro-7-(trifluoromethyl)thieno[3,2-b][1,5]benzoxazepine
SYSTEMATIC NAME: 4-chloranyl-7-(trifluoromethyl)thieno[3,2-b][1,5]benzoxazepine
MOLECULAR FORMULA: C12H5ClF3NOS
MOLECULAR WEIGHT: 303.68741
SMILES: C1=CC2=C(C=C1C(F)(F)F)N=C(C3=C(O2)C=CS3)Cl
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Product OPENEYE NAME: 2-methyl-3-phenyl-2H-pyrido[3,2-e][1,3]thiazin-4-one
CAS Name: 2-methyl-3-phenyl-2H-pyrido[3,2-e][1,3]thiazin-4-one
IUPAC NAME: 2-methyl-3-phenyl-2H-pyrido[3,2-e][1,3]thiazin-4-one
SYSTEMATIC NAME: 2-methyl-3-phenyl-2H-pyrido[3,2-e][1,3]thiazin-4-one
MOLECULAR FORMULA: C14H12N2OS
MOLECULAR WEIGHT: 256.32288
SMILES: CC1N(C(=O)C2=C(S1)N=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: 3-(4-chlorophenyl)-2-methyl-2H-pyrido[3,2-e][1,3]thiazin-4-one
CAS Name: 3-(4-chlorophenyl)-2-methyl-2H-pyrido[3,2-e][1,3]thiazin-4-one
IUPAC NAME: 3-(4-chlorophenyl)-2-methyl-2H-pyrido[3,2-e][1,3]thiazin-4-one
SYSTEMATIC NAME: 3-(4-chlorophenyl)-2-methyl-2H-pyrido[3,2-e][1,3]thiazin-4-one
MOLECULAR FORMULA: C14H11ClN2OS
MOLECULAR WEIGHT: 290.76794
SMILES: CC1N(C(=O)C2=C(S1)N=CC=C2)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-methyl-3-(p-tolyl)-2H-pyrido[3,2-e][1,3]thiazin-4-one
CAS Name: 2-methyl-3-(4-methylphenyl)-2H-pyrido[3,2-e][1,3]thiazin-4-one
IUPAC NAME: 2-methyl-3-(4-methylphenyl)-2H-pyrido[3,2-e][1,3]thiazin-4-one
SYSTEMATIC NAME: 2-methyl-3-(4-methylphenyl)-2H-pyrido[3,2-e][1,3]thiazin-4-one
MOLECULAR FORMULA: C15H14N2OS
MOLECULAR WEIGHT: 270.34946
SMILES: CC1N(C(=O)C2=C(S1)N=CC=C2)C3=CC=C(C=C3)C
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Product OPENEYE NAME: 3-(4-methoxyphenyl)-2-methyl-2H-pyrido[3,2-e][1,3]thiazin-4-one
CAS Name: 3-(4-methoxyphenyl)-2-methyl-2H-pyrido[3,2-e][1,3]thiazin-4-one
IUPAC NAME: 3-(4-methoxyphenyl)-2-methyl-2H-pyrido[3,2-e][1,3]thiazin-4-one
SYSTEMATIC NAME: 3-(4-methoxyphenyl)-2-methyl-2H-pyrido[3,2-e][1,3]thiazin-4-one
MOLECULAR FORMULA: C15H14N2O2S
MOLECULAR WEIGHT: 286.34886
SMILES: CC1N(C(=O)C2=C(S1)N=CC=C2)C3=CC=C(C=C3)OC
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Product OPENEYE NAME: 2-(4-chloroanilino)-N-[2,6-diamino-5-[2-(4-chlorophenyl)hydrazino]pyrimidin-4-yl]imino-acetamide
CAS Name: 2-(4-chloroanilino)-N-[[2,6-diamino-5-[(4-chlorophenyl)hydrazo]-4-pyrimidinyl]imino]acetamide
IUPAC NAME: 2-(4-chloroanilino)-N-[2,6-diamino-5-[2-(4-chlorophenyl)hydrazinyl]pyrimidin-4-yl]iminoacetamide
SYSTEMATIC NAME: N-[2,6-bis(azanyl)-5-[2-(4-chlorophenyl)hydrazinyl]pyrimidin-4-yl]imino-2-[(4-chlorophenyl)amino]ethanamide
MOLECULAR FORMULA: C18H17Cl2N9O
MOLECULAR WEIGHT: 446.29328
SMILES: C1=CC(=CC=C1NCC(=O)N=NC2=C(C(=NC(=N2)N)N)NNC3=CC=C(C=C3)Cl)Cl
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