Friday, January 25, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2-[1-(4-fluorophenyl)ethylsulfanyl]-4,5-dihydrothiazole
CAS Name: 2-[1-(4-fluorophenyl)ethylthio]-4,5-dihydrothiazole
IUPAC NAME: 2-[1-(4-fluorophenyl)ethylsulfanyl]-4,5-dihydro-1,3-thiazole
SYSTEMATIC NAME: 2-[1-(4-fluorophenyl)ethylsulfanyl]-4,5-dihydro-1,3-thiazole
MOLECULAR FORMULA: C11H12FNS2
MOLECULAR WEIGHT: 241.348083
SMILES: CC(C1=CC=C(C=C1)F)SC2=NCCS2
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Product OPENEYE NAME: 2-[2-(3-methylphenoxy)ethylsulfanyl]-4,5-dihydrothiazole
CAS Name: 2-[2-(3-methylphenoxy)ethylthio]-4,5-dihydrothiazole
IUPAC NAME: 2-[2-(3-methylphenoxy)ethylsulfanyl]-4,5-dihydro-1,3-thiazole
SYSTEMATIC NAME: 2-[2-(3-methylphenoxy)ethylsulfanyl]-4,5-dihydro-1,3-thiazole
MOLECULAR FORMULA: C12H15NOS2
MOLECULAR WEIGHT: 253.3836
SMILES: CC1=CC(=CC=C1)OCCSC2=NCCS2
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Product OPENEYE NAME: 2-[2-(2-methylphenoxy)ethylsulfanyl]-4,5-dihydrothiazole
CAS Name: 2-[2-(2-methylphenoxy)ethylthio]-4,5-dihydrothiazole
IUPAC NAME: 2-[2-(2-methylphenoxy)ethylsulfanyl]-4,5-dihydro-1,3-thiazole
SYSTEMATIC NAME: 2-[2-(2-methylphenoxy)ethylsulfanyl]-4,5-dihydro-1,3-thiazole
MOLECULAR FORMULA: C12H15NOS2
MOLECULAR WEIGHT: 253.3836
SMILES: CC1=CC=CC=C1OCCSC2=NCCS2
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Product OPENEYE NAME: 4-(4,5-dihydrothiazol-2-ylsulfanylmethyl)-2-phenyl-oxazole
CAS Name: 4-[(4,5-dihydrothiazol-2-ylthio)methyl]-2-phenyloxazole
IUPAC NAME: 4-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-2-phenyl-1,3-oxazole
SYSTEMATIC NAME: 4-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-2-phenyl-1,3-oxazole
MOLECULAR FORMULA: C13H12N2OS2
MOLECULAR WEIGHT: 276.37718
SMILES: C1CSC(=N1)SCC2=COC(=N2)C3=CC=CC=C3
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Product OPENEYE NAME: 2-(4,5-dihydrothiazol-2-ylsulfanylmethyl)-5-phenyl-1,3,4-oxadiazole
CAS Name: 2-[(4,5-dihydrothiazol-2-ylthio)methyl]-5-phenyl-1,3,4-oxadiazole
IUPAC NAME: 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-5-phenyl-1,3,4-oxadiazole
SYSTEMATIC NAME: 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-5-phenyl-1,3,4-oxadiazole
MOLECULAR FORMULA: C12H11N3OS2
MOLECULAR WEIGHT: 277.36524
SMILES: C1CSC(=N1)SCC2=NN=C(O2)C3=CC=CC=C3
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Product OPENEYE NAME: 2-(4,5-dihydrothiazol-2-ylsulfanyl)-N-(2-methoxy-1-methyl-ethyl)acetamide
CAS Name: 2-(4,5-dihydrothiazol-2-ylthio)-N-(1-methoxypropan-2-yl)acetamide
IUPAC NAME: 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(1-methoxypropan-2-yl)acetamide
SYSTEMATIC NAME: 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(1-methoxypropan-2-yl)ethanamide
MOLECULAR FORMULA: C9H16N2O2S2
MOLECULAR WEIGHT: 248.36554
SMILES: CC(COC)NC(=O)CSC1=NCCS1
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Product OPENEYE NAME: 2-(4,5-dihydrothiazol-2-ylsulfanyl)-N-(1,1-dioxothiolan-3-yl)-N-methyl-acetamide
CAS Name: 2-(4,5-dihydrothiazol-2-ylthio)-N-(1,1-dioxo-3-thiolanyl)-N-methylacetamide
IUPAC NAME: 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(1,1-dioxothiolan-3-yl)-N-methylacetamide
SYSTEMATIC NAME: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-methyl-ethanamide
MOLECULAR FORMULA: C10H16N2O3S3
MOLECULAR WEIGHT: 308.44064
SMILES: CN(C1CCS(=O)(=O)C1)C(=O)CSC2=NCCS2
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Product OPENEYE NAME: 6-(4,5-dihydrothiazol-2-ylsulfanylmethyl)-N2-(o-tolyl)-1,3,5-triazine-2,4-diamine
CAS Name: 6-[(4,5-dihydrothiazol-2-ylthio)methyl]-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine
IUPAC NAME: 6-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: 6-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C14H16N6S2
MOLECULAR WEIGHT: 332.44704
SMILES: CC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=NCCS3
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Product OPENEYE NAME: 2-(4,5-dihydrothiazol-2-ylsulfanylmethyl)-5-phenyl-oxazole
CAS Name: 2-[(4,5-dihydrothiazol-2-ylthio)methyl]-5-phenyloxazole
IUPAC NAME: 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-5-phenyl-1,3-oxazole
SYSTEMATIC NAME: 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-5-phenyl-1,3-oxazole
MOLECULAR FORMULA: C13H12N2OS2
MOLECULAR WEIGHT: 276.37718
SMILES: C1CSC(=N1)SCC2=NC=C(O2)C3=CC=CC=C3
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Product OPENEYE NAME: 2-[(3-methylquinoxalin-2-yl)methylsulfanyl]-4,5-dihydrothiazole
CAS Name: 2-[(3-methyl-2-quinoxalinyl)methylthio]-4,5-dihydrothiazole
IUPAC NAME: 2-[(3-methylquinoxalin-2-yl)methylsulfanyl]-4,5-dihydro-1,3-thiazole
SYSTEMATIC NAME: 2-[(3-methylquinoxalin-2-yl)methylsulfanyl]-4,5-dihydro-1,3-thiazole
MOLECULAR FORMULA: C13H13N3S2
MOLECULAR WEIGHT: 275.39242
SMILES: CC1=NC2=CC=CC=C2N=C1CSC3=NCCS3
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Product OPENEYE NAME: 2-[2-(4-methoxyphenyl)ethylsulfanyl]-4,5-dihydrothiazole
CAS Name: 2-[2-(4-methoxyphenyl)ethylthio]-4,5-dihydrothiazole
IUPAC NAME: 2-[2-(4-methoxyphenyl)ethylsulfanyl]-4,5-dihydro-1,3-thiazole
SYSTEMATIC NAME: 2-[2-(4-methoxyphenyl)ethylsulfanyl]-4,5-dihydro-1,3-thiazole
MOLECULAR FORMULA: C12H15NOS2
MOLECULAR WEIGHT: 253.3836
SMILES: COC1=CC=C(C=C1)CCSC2=NCCS2
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Product OPENEYE NAME: 2-[(2-ethoxyphenyl)methylsulfanyl]-4,5-dihydrothiazole
CAS Name: 2-[(2-ethoxyphenyl)methylthio]-4,5-dihydrothiazole
IUPAC NAME: 2-[(2-ethoxyphenyl)methylsulfanyl]-4,5-dihydro-1,3-thiazole
SYSTEMATIC NAME: 2-[(2-ethoxyphenyl)methylsulfanyl]-4,5-dihydro-1,3-thiazole
MOLECULAR FORMULA: C12H15NOS2
MOLECULAR WEIGHT: 253.3836
SMILES: CCOC1=CC=CC=C1CSC2=NCCS2
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Product OPENEYE NAME: (2-oxo-2-ureido-ethyl) 2,2-dichloro-1-methyl-cyclopropanecarboxylate
CAS Name: 2,2-dichloro-1-methyl-1-cyclopropanecarboxylic acid [2-(carbamoylamino)-2-oxoethyl] ester
IUPAC NAME: [2-(carbamoylamino)-2-oxoethyl] 2,2-dichloro-1-methylcyclopropane-1-carboxylate
SYSTEMATIC NAME: [2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 2,2-bis(chloranyl)-1-methyl-cyclopropane-1-carboxylate
MOLECULAR FORMULA: C8H10Cl2N2O4
MOLECULAR WEIGHT: 269.082
SMILES: CC1(CC1(Cl)Cl)C(=O)OCC(=O)NC(=O)N
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Product OPENEYE NAME: 1-(2,6-dimethylmorpholin-4-yl)-2-(2-furylmethylsulfanyl)ethanone
CAS Name: 1-(2,6-dimethyl-4-morpholinyl)-2-(2-furanylmethylthio)ethanone
IUPAC NAME: 1-(2,6-dimethylmorpholin-4-yl)-2-(furan-2-ylmethylsulfanyl)ethanone
SYSTEMATIC NAME: 1-(2,6-dimethylmorpholin-4-yl)-2-(furan-2-ylmethylsulfanyl)ethanone
MOLECULAR FORMULA: C13H19NO3S
MOLECULAR WEIGHT: 269.35986
SMILES: CC1CN(CC(O1)C)C(=O)CSCC2=CC=CO2
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Product OPENEYE NAME: 6-[2-(2-furylmethylsulfanyl)acetyl]-4H-1,4-benzoxazin-3-one
CAS Name: 6-[2-(2-furanylmethylthio)-1-oxoethyl]-4H-1,4-benzoxazin-3-one
IUPAC NAME: 6-[2-(furan-2-ylmethylsulfanyl)acetyl]-4H-1,4-benzoxazin-3-one
SYSTEMATIC NAME: 6-[2-(furan-2-ylmethylsulfanyl)ethanoyl]-4H-1,4-benzoxazin-3-one
MOLECULAR FORMULA: C15H13NO4S
MOLECULAR WEIGHT: 303.33302
SMILES: C1C(=O)NC2=C(O1)C=CC(=C2)C(=O)CSCC3=CC=CO3
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Product OPENEYE NAME: 2-[1-(2-furylmethylsulfanyl)ethyl]-1H-quinazolin-4-one
CAS Name: 2-[1-(2-furanylmethylthio)ethyl]-1H-quinazolin-4-one
IUPAC NAME: 2-[1-(furan-2-ylmethylsulfanyl)ethyl]-1H-quinazolin-4-one
SYSTEMATIC NAME: 2-[1-(furan-2-ylmethylsulfanyl)ethyl]-1H-quinazolin-4-one
MOLECULAR FORMULA: C15H14N2O2S
MOLECULAR WEIGHT: 286.34886
SMILES: CC(C1=NC(=O)C2=CC=CC=C2N1)SCC3=CC=CO3
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Product OPENEYE NAME: 2-(2-furylmethylsulfanyl)-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone
CAS Name: 2-(2-furanylmethylthio)-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone
IUPAC NAME: 2-(furan-2-ylmethylsulfanyl)-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone
SYSTEMATIC NAME: 2-(furan-2-ylmethylsulfanyl)-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone
MOLECULAR FORMULA: C16H16N2O2S
MOLECULAR WEIGHT: 300.37544
SMILES: C1CN(N=C1C2=CC=CC=C2)C(=O)CSCC3=CC=CO3
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Product OPENEYE NAME: [2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl] 5-nitrofuran-2-carboxylate
CAS Name: 5-nitro-2-furancarboxylic acid [1-(1H-indol-3-yl)-1-oxopropan-2-yl] ester
IUPAC NAME: [1-(1H-indol-3-yl)-1-oxopropan-2-yl] 5-nitrofuran-2-carboxylate
SYSTEMATIC NAME: [1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 5-nitrofuran-2-carboxylate
MOLECULAR FORMULA: C16H12N2O6
MOLECULAR WEIGHT: 328.27628
SMILES: CC(C(=O)C1=CNC2=CC=CC=C21)OC(=O)C3=CC=C(O3)[N+](=O)[O-]
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Product OPENEYE NAME: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 5-nitrofuran-2-carboxylate
CAS Name: 5-nitro-2-furancarboxylic acid 1-(4-oxo-1H-quinazolin-2-yl)ethyl ester
IUPAC NAME: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 5-nitrofuran-2-carboxylate
SYSTEMATIC NAME: 1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 5-nitrofuran-2-carboxylate
MOLECULAR FORMULA: C15H11N3O6
MOLECULAR WEIGHT: 329.26434
SMILES: CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)C3=CC=C(O3)[N+](=O)[O-]
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Product OPENEYE NAME: 2-(2-quinolylsulfanyl)propanenitrile
CAS Name: 2-(2-quinolinylthio)propanenitrile
IUPAC NAME: 2-quinolin-2-ylsulfanylpropanenitrile
SYSTEMATIC NAME: 2-quinolin-2-ylsulfanylpropanenitrile
MOLECULAR FORMULA: C12H10N2S
MOLECULAR WEIGHT: 214.2862
SMILES: CC(C#N)SC1=NC2=CC=CC=C2C=C1
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Product OPENEYE NAME: 2-(benzimidazol-1-yl)-N-(1,1-dioxothiolan-3-yl)acetamide
CAS Name: 2-(1-benzimidazolyl)-N-(1,1-dioxo-3-thiolanyl)acetamide
IUPAC NAME: 2-(benzimidazol-1-yl)-N-(1,1-dioxothiolan-3-yl)acetamide
SYSTEMATIC NAME: 2-(benzimidazol-1-yl)-N-[1,1-bis(oxidanylidene)thiolan-3-yl]ethanamide
MOLECULAR FORMULA: C13H15N3O3S
MOLECULAR WEIGHT: 293.3415
SMILES: C1CS(=O)(=O)CC1NC(=O)CN2C=NC3=CC=CC=C32
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Product OPENEYE NAME: 2-(4-acetylphenoxy)-1-(3-methoxyphenyl)ethanone
CAS Name: 2-(4-acetylphenoxy)-1-(3-methoxyphenyl)ethanone
IUPAC NAME: 2-(4-acetylphenoxy)-1-(3-methoxyphenyl)ethanone
SYSTEMATIC NAME: 2-(4-ethanoylphenoxy)-1-(3-methoxyphenyl)ethanone
MOLECULAR FORMULA: C17H16O4
MOLECULAR WEIGHT: 284.30654
SMILES: CC(=O)C1=CC=C(C=C1)OCC(=O)C2=CC(=CC=C2)OC
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