Tuesday, November 27, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 3-methoxy-1-[(5-phenacylsulfanyl-1,3,4-oxadiazol-2-yl)methyl]pyridin-2-one
CAS Name: 3-methoxy-1-[[5-(phenacylthio)-1,3,4-oxadiazol-2-yl]methyl]-2-pyridinone
IUPAC NAME: 3-methoxy-1-[(5-phenacylsulfanyl-1,3,4-oxadiazol-2-yl)methyl]pyridin-2-one
SYSTEMATIC NAME: 3-methoxy-1-[(5-phenacylsulfanyl-1,3,4-oxadiazol-2-yl)methyl]pyridin-2-one
MOLECULAR FORMULA: C17H15N3O4S
MOLECULAR WEIGHT: 357.3837
SMILES: COC1=CC=CN(C1=O)CC2=NN=C(O2)SCC(=O)C3=CC=CC=C3
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Product OPENEYE NAME: S-(2,4-dichlorophenyl) 2-[4-(2,1,3-benzoxadiazol-5-ylmethoxy)phenyl]thiazole-4-carbothioate
CAS Name: 2-[4-(2,1,3-benzoxadiazol-5-ylmethoxy)phenyl]-4-thiazolecarbothioic acid S-(2,4-dichlorophenyl) ester
IUPAC NAME: S-(2,4-dichlorophenyl) 2-[4-(2,1,3-benzoxadiazol-5-ylmethoxy)phenyl]-1,3-thiazole-4-carbothioate
SYSTEMATIC NAME: S-(2,4-dichlorophenyl) 2-[4-(2,1,3-benzoxadiazol-5-ylmethoxy)phenyl]-1,3-thiazole-4-carbothioate
MOLECULAR FORMULA: C23H13Cl2N3O3S2
MOLECULAR WEIGHT: 514.40362
SMILES: C1=CC(=CC=C1C2=NC(=CS2)C(=O)SC3=C(C=C(C=C3)Cl)Cl)OCC4=CC5=NON=C5C=C4
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Product OPENEYE NAME: S-[3-(trifluoromethyl)phenyl] 2-[4-(2,1,3-benzoxadiazol-5-ylmethoxy)phenyl]thiazole-4-carbothioate
CAS Name: 2-[4-(2,1,3-benzoxadiazol-5-ylmethoxy)phenyl]-4-thiazolecarbothioic acid S-[3-(trifluoromethyl)phenyl] ester
IUPAC NAME: S-[3-(trifluoromethyl)phenyl] 2-[4-(2,1,3-benzoxadiazol-5-ylmethoxy)phenyl]-1,3-thiazole-4-carbothioate
SYSTEMATIC NAME: S-[3-(trifluoromethyl)phenyl] 2-[4-(2,1,3-benzoxadiazol-5-ylmethoxy)phenyl]-1,3-thiazole-4-carbothioate
MOLECULAR FORMULA: C24H14F3N3O3S2
MOLECULAR WEIGHT: 513.51147
SMILES: C1=CC(=CC(=C1)SC(=O)C2=CSC(=N2)C3=CC=C(C=C3)OCC4=CC5=NON=C5C=C4)C(F)(F)F
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Product OPENEYE NAME: [[1-amino-2-(2,1,3-benzoxadiazol-5-yloxy)ethylidene]amino] 4-chlorobenzoate
CAS Name: 4-chlorobenzoic acid [[1-amino-2-(2,1,3-benzoxadiazol-5-yloxy)ethylidene]amino] ester
IUPAC NAME: [[1-amino-2-(2,1,3-benzoxadiazol-5-yloxy)ethylidene]amino] 4-chlorobenzoate
SYSTEMATIC NAME: [[1-azanyl-2-(2,1,3-benzoxadiazol-5-yloxy)ethylidene]amino] 4-chloranylbenzoate
MOLECULAR FORMULA: C15H11ClN4O4
MOLECULAR WEIGHT: 346.72524
SMILES: C1=CC(=CC=C1C(=O)ON=C(COC2=CC3=NON=C3C=C2)N)Cl
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Product OPENEYE NAME: 5-[[4-(4-chlorophenyl)thiazol-2-yl]methoxy]-2,1,3-benzoxadiazole
CAS Name: 5-[[4-(4-chlorophenyl)-2-thiazolyl]methoxy]-2,1,3-benzoxadiazole
IUPAC NAME: 5-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]methoxy]-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 5-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]methoxy]-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C16H10ClN3O2S
MOLECULAR WEIGHT: 343.7875
SMILES: C1=CC(=CC=C1C2=CSC(=N2)COC3=CC4=NON=C4C=C3)Cl
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Product OPENEYE NAME: 2-(2-chlorobenzothiophen-3-yl)-1-(1-piperidyl)ethanone
CAS Name: 2-(2-chloro-1-benzothiophen-3-yl)-1-(1-piperidinyl)ethanone
IUPAC NAME: 2-(2-chloro-1-benzothiophen-3-yl)-1-piperidin-1-ylethanone
SYSTEMATIC NAME: 2-(2-chloranyl-1-benzothiophen-3-yl)-1-piperidin-1-yl-ethanone
MOLECULAR FORMULA: C15H16ClNOS
MOLECULAR WEIGHT: 293.81164
SMILES: C1CCN(CC1)C(=O)CC2=C(SC3=CC=CC=C32)Cl
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Product OPENEYE NAME: 2-(2-chlorobenzothiophen-3-yl)-N-ethyl-acetamide
CAS Name: 2-(2-chloro-1-benzothiophen-3-yl)-N-ethylacetamide
IUPAC NAME: 2-(2-chloro-1-benzothiophen-3-yl)-N-ethylacetamide
SYSTEMATIC NAME: 2-(2-chloranyl-1-benzothiophen-3-yl)-N-ethyl-ethanamide
MOLECULAR FORMULA: C12H12ClNOS
MOLECULAR WEIGHT: 253.74778
SMILES: CCNC(=O)CC1=C(SC2=CC=CC=C21)Cl
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Product OPENEYE NAME: 2-(2-chlorobenzothiophen-3-yl)-1-pyrrolidin-1-yl-ethanone
CAS Name: 2-(2-chloro-1-benzothiophen-3-yl)-1-(1-pyrrolidinyl)ethanone
IUPAC NAME: 2-(2-chloro-1-benzothiophen-3-yl)-1-pyrrolidin-1-ylethanone
SYSTEMATIC NAME: 2-(2-chloranyl-1-benzothiophen-3-yl)-1-pyrrolidin-1-yl-ethanone
MOLECULAR FORMULA: C14H14ClNOS
MOLECULAR WEIGHT: 279.78506
SMILES: C1CCN(C1)C(=O)CC2=C(SC3=CC=CC=C32)Cl
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Product OPENEYE NAME: 2-(2-chlorobenzothiophen-3-yl)-N,N-diethyl-acetamide
CAS Name: 2-(2-chloro-1-benzothiophen-3-yl)-N,N-diethylacetamide
IUPAC NAME: 2-(2-chloro-1-benzothiophen-3-yl)-N,N-diethylacetamide
SYSTEMATIC NAME: 2-(2-chloranyl-1-benzothiophen-3-yl)-N,N-diethyl-ethanamide
MOLECULAR FORMULA: C14H16ClNOS
MOLECULAR WEIGHT: 281.80094
SMILES: CCN(CC)C(=O)CC1=C(SC2=CC=CC=C21)Cl
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Product OPENEYE NAME: N-[2-(2,1,3-benzoxadiazol-5-ylmethylsulfanyl)phenyl]thiophene-2-sulfonamide
CAS Name: N-[2-(2,1,3-benzoxadiazol-5-ylmethylthio)phenyl]-2-thiophenesulfonamide
IUPAC NAME: N-[2-(2,1,3-benzoxadiazol-5-ylmethylsulfanyl)phenyl]thiophene-2-sulfonamide
SYSTEMATIC NAME: N-[2-(2,1,3-benzoxadiazol-5-ylmethylsulfanyl)phenyl]thiophene-2-sulfonamide
MOLECULAR FORMULA: C17H13N3O3S3
MOLECULAR WEIGHT: 403.49842
SMILES: C1=CC=C(C(=C1)NS(=O)(=O)C2=CC=CS2)SCC3=CC4=NON=C4C=C3
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Product OPENEYE NAME: N-(2,4-dichlorophenyl)-1,3-benzothiazole-6-carboxamide
CAS Name: N-(2,4-dichlorophenyl)-1,3-benzothiazole-6-carboxamide
IUPAC NAME: N-(2,4-dichlorophenyl)-1,3-benzothiazole-6-carboxamide
SYSTEMATIC NAME: N-(2,4-dichlorophenyl)-1,3-benzothiazole-6-carboxamide
MOLECULAR FORMULA: C14H8Cl2N2OS
MOLECULAR WEIGHT: 323.19712
SMILES: C1=CC2=C(C=C1C(=O)NC3=C(C=C(C=C3)Cl)Cl)SC=N2
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Product OPENEYE NAME: 5-[[4-(4-methoxyphenyl)thiazol-2-yl]methoxy]-2,1,3-benzoxadiazole
CAS Name: 5-[[4-(4-methoxyphenyl)-2-thiazolyl]methoxy]-2,1,3-benzoxadiazole
IUPAC NAME: 5-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]methoxy]-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 5-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]methoxy]-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C17H13N3O3S
MOLECULAR WEIGHT: 339.36842
SMILES: COC1=CC=C(C=C1)C2=CSC(=N2)COC3=CC4=NON=C4C=C3
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Product OPENEYE NAME: 5-[[4-(4-nitrophenyl)thiazol-2-yl]methoxy]-2,1,3-benzoxadiazole
CAS Name: 5-[[4-(4-nitrophenyl)-2-thiazolyl]methoxy]-2,1,3-benzoxadiazole
IUPAC NAME: 5-[[4-(4-nitrophenyl)-1,3-thiazol-2-yl]methoxy]-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 5-[[4-(4-nitrophenyl)-1,3-thiazol-2-yl]methoxy]-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C16H10N4O4S
MOLECULAR WEIGHT: 354.34
SMILES: C1=CC(=CC=C1C2=CSC(=N2)COC3=CC4=NON=C4C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: ethyl 2-(2,1,3-benzoxadiazol-5-yloxymethyl)-4-methyl-thiazole-5-carboxylate
CAS Name: 2-(2,1,3-benzoxadiazol-5-yloxymethyl)-4-methyl-5-thiazolecarboxylic acid ethyl ester
IUPAC NAME: ethyl 2-(2,1,3-benzoxadiazol-5-yloxymethyl)-4-methyl-1,3-thiazole-5-carboxylate
SYSTEMATIC NAME: ethyl 2-(2,1,3-benzoxadiazol-5-yloxymethyl)-4-methyl-1,3-thiazole-5-carboxylate
MOLECULAR FORMULA: C14H13N3O4S
MOLECULAR WEIGHT: 319.33572
SMILES: CCOC(=O)C1=C(N=C(S1)COC2=CC3=NON=C3C=C2)C
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Product OPENEYE NAME: ethyl 2-(2,1,3-benzoxadiazol-5-yloxymethyl)thiazole-4-carboxylate
CAS Name: 2-(2,1,3-benzoxadiazol-5-yloxymethyl)-4-thiazolecarboxylic acid ethyl ester
IUPAC NAME: ethyl 2-(2,1,3-benzoxadiazol-5-yloxymethyl)-1,3-thiazole-4-carboxylate
SYSTEMATIC NAME: ethyl 2-(2,1,3-benzoxadiazol-5-yloxymethyl)-1,3-thiazole-4-carboxylate
MOLECULAR FORMULA: C13H11N3O4S
MOLECULAR WEIGHT: 305.30914
SMILES: CCOC(=O)C1=CSC(=N1)COC2=CC3=NON=C3C=C2
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Product OPENEYE NAME: 2-(2,1,3-benzoxadiazol-5-yloxymethyl)thiazole-4-carboxylic acid
CAS Name: 2-(2,1,3-benzoxadiazol-5-yloxymethyl)-4-thiazolecarboxylic acid
IUPAC NAME: 2-(2,1,3-benzoxadiazol-5-yloxymethyl)-1,3-thiazole-4-carboxylic acid
SYSTEMATIC NAME: 2-(2,1,3-benzoxadiazol-5-yloxymethyl)-1,3-thiazole-4-carboxylic acid
MOLECULAR FORMULA: C11H7N3O4S
MOLECULAR WEIGHT: 277.25598
SMILES: C1=CC2=NON=C2C=C1OCC3=NC(=CS3)C(=O)O
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Product OPENEYE NAME: 5-(4-tert-butylthiazol-2-yl)-2,1,3-benzoxadiazole
CAS Name: 5-(4-tert-butyl-2-thiazolyl)-2,1,3-benzoxadiazole
IUPAC NAME: 5-(4-tert-butyl-1,3-thiazol-2-yl)-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 5-(4-tert-butyl-1,3-thiazol-2-yl)-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C13H13N3OS
MOLECULAR WEIGHT: 259.32682
SMILES: CC(C)(C)C1=CSC(=N1)C2=CC3=NON=C3C=C2
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Product OPENEYE NAME: (4-methoxyphenyl) 2-(2,1,3-benzoxadiazol-5-yloxymethyl)thiazole-4-carboxylate
CAS Name: 2-(2,1,3-benzoxadiazol-5-yloxymethyl)-4-thiazolecarboxylic acid (4-methoxyphenyl) ester
IUPAC NAME: (4-methoxyphenyl) 2-(2,1,3-benzoxadiazol-5-yloxymethyl)-1,3-thiazole-4-carboxylate
SYSTEMATIC NAME: (4-methoxyphenyl) 2-(2,1,3-benzoxadiazol-5-yloxymethyl)-1,3-thiazole-4-carboxylate
MOLECULAR FORMULA: C18H13N3O5S
MOLECULAR WEIGHT: 383.37792
SMILES: COC1=CC=C(C=C1)OC(=O)C2=CSC(=N2)COC3=CC4=NON=C4C=C3
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