Product OPENEYE NAME: (E)-3-methylsulfanyl-1-phenyl-3-(p-tolylmethylamino)prop-2-ene-1-thione
CAS Name: (E)-3-[(4-methylphenyl)methylamino]-3-(methylthio)-1-phenyl-2-propene-1-thione
IUPAC NAME: (E)-3-[(4-methylphenyl)methylamino]-3-methylsulfanyl-1-phenylprop-2-ene-1-thione
SYSTEMATIC NAME: (E)-3-[(4-methylphenyl)methylamino]-3-methylsulfanyl-1-phenyl-prop-2-ene-1-thione
MOLECULAR FORMULA: C18H19NS2
MOLECULAR WEIGHT: 313.48016
SMILES: CC1=CC=C(C=C1)CN/C(=C\C(=S)C2=CC=CC=C2)/SC
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Product OPENEYE NAME: (E)-3-[(2-chlorophenyl)methylamino]-3-methylsulfanyl-1-phenyl-prop-2-ene-1-thione
CAS Name: (E)-3-[(2-chlorophenyl)methylamino]-3-(methylthio)-1-phenyl-2-propene-1-thione
IUPAC NAME: (E)-3-[(2-chlorophenyl)methylamino]-3-methylsulfanyl-1-phenylprop-2-ene-1-thione
SYSTEMATIC NAME: (E)-3-[(2-chlorophenyl)methylamino]-3-methylsulfanyl-1-phenyl-prop-2-ene-1-thione
MOLECULAR FORMULA: C17H16ClNS2
MOLECULAR WEIGHT: 333.89864
SMILES: CS/C(=C/C(=S)C1=CC=CC=C1)/NCC2=CC=CC=C2Cl
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Product OPENEYE NAME: (E)-3-[(3-chlorophenyl)methylamino]-3-methylsulfanyl-1-phenyl-prop-2-ene-1-thione
CAS Name: (E)-3-[(3-chlorophenyl)methylamino]-3-(methylthio)-1-phenyl-2-propene-1-thione
IUPAC NAME: (E)-3-[(3-chlorophenyl)methylamino]-3-methylsulfanyl-1-phenylprop-2-ene-1-thione
SYSTEMATIC NAME: (E)-3-[(3-chlorophenyl)methylamino]-3-methylsulfanyl-1-phenyl-prop-2-ene-1-thione
MOLECULAR FORMULA: C17H16ClNS2
MOLECULAR WEIGHT: 333.89864
SMILES: CS/C(=C/C(=S)C1=CC=CC=C1)/NCC2=CC(=CC=C2)Cl
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Product OPENEYE NAME: (E)-3-benzylsulfanyl-1-phenyl-3-(2-phenylethylamino)prop-2-ene-1-thione
CAS Name: (E)-1-phenyl-3-(2-phenylethylamino)-3-(phenylmethylthio)-2-propene-1-thione
IUPAC NAME: (E)-3-benzylsulfanyl-1-phenyl-3-(2-phenylethylamino)prop-2-ene-1-thione
SYSTEMATIC NAME: (E)-1-phenyl-3-(2-phenylethylamino)-3-(phenylmethylsulfanyl)prop-2-ene-1-thione
MOLECULAR FORMULA: C24H23NS2
MOLECULAR WEIGHT: 389.57612
SMILES: C1=CC=C(C=C1)CCN/C(=C\C(=S)C2=CC=CC=C2)/SCC3=CC=CC=C3
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Product OPENEYE NAME: 3-methyl-6-phenyl-1,3-thiazine-2,4-dione
CAS Name: 3-methyl-6-phenyl-1,3-thiazine-2,4-dione
IUPAC NAME: 3-methyl-6-phenyl-1,3-thiazine-2,4-dione
SYSTEMATIC NAME: 3-methyl-6-phenyl-1,3-thiazine-2,4-dione
MOLECULAR FORMULA: C11H9NO2S
MOLECULAR WEIGHT: 219.25966
SMILES: CN1C(=O)C=C(SC1=O)C2=CC=CC=C2
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Product OPENEYE NAME: 3-methyl-6-phenyl-4-thioxo-1,3-thiazin-2-one
CAS Name: 3-methyl-6-phenyl-4-sulfanylidene-1,3-thiazin-2-one
IUPAC NAME: 3-methyl-6-phenyl-4-sulfanylidene-1,3-thiazin-2-one
SYSTEMATIC NAME: 3-methyl-6-phenyl-4-sulfanylidene-1,3-thiazin-2-one
MOLECULAR FORMULA: C11H9NOS2
MOLECULAR WEIGHT: 235.32526
SMILES: CN1C(=S)C=C(SC1=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-(2,4-dinitrophenyl)pyrazol-3-amine
CAS Name: 2-(2,4-dinitrophenyl)-3-pyrazolamine
IUPAC NAME: 2-(2,4-dinitrophenyl)pyrazol-3-amine
SYSTEMATIC NAME: 2-(2,4-dinitrophenyl)pyrazol-3-amine
MOLECULAR FORMULA: C9H7N5O4
MOLECULAR WEIGHT: 249.18298
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])N2C(=CC=N2)N
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Product OPENEYE NAME: ethyl 8-ethoxy-5-oxido-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-carboxylate
CAS Name: 8-ethoxy-5-oxido-3-pyrazolo[5,1-c][1,2,4]benzotriazin-5-iumcarboxylic acid ethyl ester
IUPAC NAME: ethyl 8-ethoxy-5-oxidopyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-carboxylate
SYSTEMATIC NAME: ethyl 8-ethoxy-5-oxidanidyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-carboxylate
MOLECULAR FORMULA: C14H14N4O4
MOLECULAR WEIGHT: 302.28536
SMILES: CCOC1=CC2=C(C=C1)[N+](=NC3=C(C=NN23)C(=O)OCC)[O-]
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Product OPENEYE NAME: 5-oxidopyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-carboxamide
CAS Name: 5-oxido-3-pyrazolo[5,1-c][1,2,4]benzotriazin-5-iumcarboxamide
IUPAC NAME: 5-oxidopyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-carboxamide
SYSTEMATIC NAME: 5-oxidanidylpyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-carboxamide
MOLECULAR FORMULA: C10H7N5O2
MOLECULAR WEIGHT: 229.19488
SMILES: C1=CC=C2C(=C1)N3C(=C(C=N3)C(=O)N)N=[N+]2[O-]
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Product OPENEYE NAME: 2-amino-6-(isopropylamino)-1H-pyrimidin-4-one
CAS Name: 2-amino-6-(propan-2-ylamino)-1H-pyrimidin-4-one
IUPAC NAME: 2-amino-6-(propan-2-ylamino)-1H-pyrimidin-4-one
SYSTEMATIC NAME: 2-azanyl-6-(propan-2-ylamino)-1H-pyrimidin-4-one
MOLECULAR FORMULA: C7H12N4O
MOLECULAR WEIGHT: 168.19638
SMILES: CC(C)NC1=CC(=O)N=C(N1)N
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Product OPENEYE NAME: methyl 3-[[(2S,3R)-6-methoxy-2-methyl-4-oxo-chroman-3-yl]methyl]benzoate
CAS Name: 3-[[(2S,3R)-6-methoxy-2-methyl-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl]methyl]benzoic acid methyl ester
IUPAC NAME: methyl 3-[[(2S,3R)-6-methoxy-2-methyl-4-oxo-2,3-dihydrochromen-3-yl]methyl]benzoate
SYSTEMATIC NAME: methyl 3-[[(2S,3R)-6-methoxy-2-methyl-4-oxidanylidene-2,3-dihydrochromen-3-yl]methyl]benzoate
MOLECULAR FORMULA: C20H20O5
MOLECULAR WEIGHT: 340.3698
SMILES: C[C@H]1[C@H](C(=O)C2=C(O1)C=CC(=C2)OC)CC3=CC=CC(=C3)C(=O)OC
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Product OPENEYE NAME: N-[3-[[(2S,3R)-6-methoxy-2-methyl-4-oxo-chroman-3-yl]methyl]phenyl]acetamide
CAS Name: N-[3-[[(2S,3R)-6-methoxy-2-methyl-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl]methyl]phenyl]acetamide
IUPAC NAME: N-[3-[[(2S,3R)-6-methoxy-2-methyl-4-oxo-2,3-dihydrochromen-3-yl]methyl]phenyl]acetamide
SYSTEMATIC NAME: N-[3-[[(2S,3R)-6-methoxy-2-methyl-4-oxidanylidene-2,3-dihydrochromen-3-yl]methyl]phenyl]ethanamide
MOLECULAR FORMULA: C20H21NO4
MOLECULAR WEIGHT: 339.38504
SMILES: C[C@H]1[C@H](C(=O)C2=C(O1)C=CC(=C2)OC)CC3=CC(=CC=C3)NC(=O)C
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Product OPENEYE NAME: 4-amino-N-(2-oxo-1H-pyrimidin-6-yl)benzenesulfonamide
CAS Name: 4-amino-N-(2-oxo-1H-pyrimidin-6-yl)benzenesulfonamide
IUPAC NAME: 4-amino-N-(2-oxo-1H-pyrimidin-6-yl)benzenesulfonamide
SYSTEMATIC NAME: 4-azanyl-N-(2-oxidanylidene-1H-pyrimidin-6-yl)benzenesulfonamide
MOLECULAR FORMULA: C10H10N4O3S
MOLECULAR WEIGHT: 266.2764
SMILES: C1=CC(=CC=C1N)S(=O)(=O)NC2=CC=NC(=O)N2
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Product OPENEYE NAME: 5-bromobenzene-1,3-dicarboxamide
CAS Name: 5-bromobenzene-1,3-dicarboxamide
IUPAC NAME: 5-bromobenzene-1,3-dicarboxamide
SYSTEMATIC NAME: 5-bromanylbenzene-1,3-dicarboxamide
MOLECULAR FORMULA: C8H7BrN2O2
MOLECULAR WEIGHT: 243.05738
SMILES: C1=C(C=C(C=C1C(=O)N)Br)C(=O)N
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Product OPENEYE NAME: 5-bromobenzene-1,3-dicarbonitrile
CAS Name: 5-bromobenzene-1,3-dicarbonitrile
IUPAC NAME: 5-bromobenzene-1,3-dicarbonitrile
SYSTEMATIC NAME: 5-bromanylbenzene-1,3-dicarbonitrile
MOLECULAR FORMULA: C8H3BrN2
MOLECULAR WEIGHT: 207.02682
SMILES: C1=C(C=C(C=C1C#N)Br)C#N
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Product OPENEYE NAME: 2-[3-bromo-5-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4,5-dihydro-1H-imidazole
CAS Name: 2-[3-bromo-5-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4,5-dihydro-1H-imidazole
IUPAC NAME: 2-[3-bromo-5-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4,5-dihydro-1H-imidazole
SYSTEMATIC NAME: 2-[3-bromanyl-5-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4,5-dihydro-1H-imidazole
MOLECULAR FORMULA: C12H13BrN4
MOLECULAR WEIGHT: 293.16242
SMILES: C1CN=C(N1)C2=CC(=CC(=C2)Br)C3=NCCN3
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Product OPENEYE NAME: 1-[2-chloro-2-(4-chlorophenyl)ethyl]-1,2,4-triazole
CAS Name: 1-[2-chloro-2-(4-chlorophenyl)ethyl]-1,2,4-triazole
IUPAC NAME: 1-[2-chloro-2-(4-chlorophenyl)ethyl]-1,2,4-triazole
SYSTEMATIC NAME: 1-[2-chloranyl-2-(4-chlorophenyl)ethyl]-1,2,4-triazole
MOLECULAR FORMULA: C10H9Cl2N3
MOLECULAR WEIGHT: 242.10456
SMILES: C1=CC(=CC=C1C(CN2C=NC=N2)Cl)Cl
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H12N6O2
MOLECULAR WEIGHT: 368.34828
SMILES: C1=CC2=C(C=C1[N+](=O)[O-])N=C3C(=N2)N=C4N3C=CC(=C4)/C=C/C5=CC=NC=C5
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C30H16F6N8
MOLECULAR WEIGHT: 602.492059
SMILES: C1=CC2=C(N=C3N4C(=C/C(=C\C=C\5/C=C6N(C7=NC8=C(N=C7N6)C=CC(=C8)C(F)(F)F)C=C5)/C=C4)NC3=N2)C=C1C(F)(F)F
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Product OPENEYE NAME: methyl (2Z)-2-[2-(dimethylamino)-5-oxo-1-[(Z)-1-phenylethylideneamino]imidazol-4-ylidene]acetate
CAS Name: (2Z)-2-[2-(dimethylamino)-5-oxo-1-[(Z)-1-phenylethylideneamino]-4-imidazolylidene]acetic acid methyl ester
IUPAC NAME: methyl (2Z)-2-[2-(dimethylamino)-5-oxo-1-[(Z)-1-phenylethylideneamino]imidazol-4-ylidene]acetate
SYSTEMATIC NAME: methyl (2Z)-2-[2-(dimethylamino)-5-oxidanylidene-1-[(Z)-1-phenylethylideneamino]imidazol-4-ylidene]ethanoate
MOLECULAR FORMULA: C16H18N4O3
MOLECULAR WEIGHT: 314.33912
SMILES: C/C(=N/N1C(=O)/C(=C/C(=O)OC)/N=C1N(C)C)/C2=CC=CC=C2
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Product OPENEYE NAME: methyl (2Z)-2-[2-(dimethylamino)-5-oxo-1-[(Z)-1-phenylpropylideneamino]imidazol-4-ylidene]acetate
CAS Name: (2Z)-2-[2-(dimethylamino)-5-oxo-1-[(Z)-1-phenylpropylideneamino]-4-imidazolylidene]acetic acid methyl ester
IUPAC NAME: methyl (2Z)-2-[2-(dimethylamino)-5-oxo-1-[(Z)-1-phenylpropylideneamino]imidazol-4-ylidene]acetate
SYSTEMATIC NAME: methyl (2Z)-2-[2-(dimethylamino)-5-oxidanylidene-1-[(Z)-1-phenylpropylideneamino]imidazol-4-ylidene]ethanoate
MOLECULAR FORMULA: C17H20N4O3
MOLECULAR WEIGHT: 328.3657
SMILES: CC/C(=N/N1C(=O)/C(=C/C(=O)OC)/N=C1N(C)C)/C2=CC=CC=C2
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Product OPENEYE NAME: methyl (2Z)-2-[2-(dimethylamino)-5-oxo-1-[(Z)-1-phenylbutylideneamino]imidazol-4-ylidene]acetate
CAS Name: (2Z)-2-[2-(dimethylamino)-5-oxo-1-[(Z)-1-phenylbutylideneamino]-4-imidazolylidene]acetic acid methyl ester
IUPAC NAME: methyl (2Z)-2-[2-(dimethylamino)-5-oxo-1-[(Z)-1-phenylbutylideneamino]imidazol-4-ylidene]acetate
SYSTEMATIC NAME: methyl (2Z)-2-[2-(dimethylamino)-5-oxidanylidene-1-[(Z)-1-phenylbutylideneamino]imidazol-4-ylidene]ethanoate
MOLECULAR FORMULA: C18H22N4O3
MOLECULAR WEIGHT: 342.39228
SMILES: CCC/C(=N/N1C(=O)/C(=C/C(=O)OC)/N=C1N(C)C)/C2=CC=CC=C2
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