Wednesday, June 27, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 6-[2-(3,5-diphenylpyrazol-1-yl)-2-oxo-ethyl]-8-methyl-11H-indolo[3,2-c]isoquinolin-5-one
CAS Name: 6-[2-(3,5-diphenyl-1-pyrazolyl)-2-oxoethyl]-8-methyl-11H-indolo[3,2-c]isoquinolin-5-one
IUPAC NAME: 6-[2-(3,5-diphenylpyrazol-1-yl)-2-oxoethyl]-8-methyl-11H-indolo[3,2-c]isoquinolin-5-one
SYSTEMATIC NAME: 6-[2-(3,5-diphenylpyrazol-1-yl)-2-oxidanylidene-ethyl]-8-methyl-11H-indolo[3,2-c]isoquinolin-5-one
MOLECULAR FORMULA: C33H24N4O2
MOLECULAR WEIGHT: 508.56926
SMILES: CC1=CC2=C(C=C1)NC3=C2N(C(=O)C4=CC=CC=C43)CC(=O)N5C(=CC(=N5)C6=CC=CC=C6)C7=CC=CC=C7
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Product OPENEYE NAME: 8-chloro-6-[2-(3,5-diphenylpyrazol-1-yl)-2-oxo-ethyl]-11H-indolo[3,2-c]isoquinolin-5-one
CAS Name: 8-chloro-6-[2-(3,5-diphenyl-1-pyrazolyl)-2-oxoethyl]-11H-indolo[3,2-c]isoquinolin-5-one
IUPAC NAME: 8-chloro-6-[2-(3,5-diphenylpyrazol-1-yl)-2-oxoethyl]-11H-indolo[3,2-c]isoquinolin-5-one
SYSTEMATIC NAME: 8-chloranyl-6-[2-(3,5-diphenylpyrazol-1-yl)-2-oxidanylidene-ethyl]-11H-indolo[3,2-c]isoquinolin-5-one
MOLECULAR FORMULA: C32H21ClN4O2
MOLECULAR WEIGHT: 528.98774
SMILES: C1=CC=C(C=C1)C2=CC(=NN2C(=O)CN3C4=C(C5=CC=CC=C5C3=O)NC6=C4C=C(C=C6)Cl)C7=CC=CC=C7
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Product OPENEYE NAME: 6-[2-(3-methyl-5-oxo-4H-pyrazol-1-yl)-2-oxo-ethyl]-11H-indolo[3,2-c]isoquinolin-5-one
CAS Name: 6-[2-(3-methyl-5-oxo-4H-pyrazol-1-yl)-2-oxoethyl]-11H-indolo[3,2-c]isoquinolin-5-one
IUPAC NAME: 6-[2-(3-methyl-5-oxo-4H-pyrazol-1-yl)-2-oxoethyl]-11H-indolo[3,2-c]isoquinolin-5-one
SYSTEMATIC NAME: 6-[2-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)-2-oxidanylidene-ethyl]-11H-indolo[3,2-c]isoquinolin-5-one
MOLECULAR FORMULA: C21H16N4O3
MOLECULAR WEIGHT: 372.37674
SMILES: CC1=NN(C(=O)C1)C(=O)CN2C3=C(C4=CC=CC=C4C2=O)NC5=CC=CC=C53
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Product OPENEYE NAME: 8-methyl-6-[2-(3-methyl-5-oxo-4H-pyrazol-1-yl)-2-oxo-ethyl]-11H-indolo[3,2-c]isoquinolin-5-one
CAS Name: 8-methyl-6-[2-(3-methyl-5-oxo-4H-pyrazol-1-yl)-2-oxoethyl]-11H-indolo[3,2-c]isoquinolin-5-one
IUPAC NAME: 8-methyl-6-[2-(3-methyl-5-oxo-4H-pyrazol-1-yl)-2-oxoethyl]-11H-indolo[3,2-c]isoquinolin-5-one
SYSTEMATIC NAME: 8-methyl-6-[2-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)-2-oxidanylidene-ethyl]-11H-indolo[3,2-c]isoquinolin-5-one
MOLECULAR FORMULA: C22H18N4O3
MOLECULAR WEIGHT: 386.40332
SMILES: CC1=NN(C(=O)C1)C(=O)CN2C3=C(C4=CC=CC=C4C2=O)NC5=C3C=C(C=C5)C
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Product OPENEYE NAME: 8-chloro-6-[2-(3-methyl-5-oxo-4H-pyrazol-1-yl)-2-oxo-ethyl]-11H-indolo[3,2-c]isoquinolin-5-one
CAS Name: 8-chloro-6-[2-(3-methyl-5-oxo-4H-pyrazol-1-yl)-2-oxoethyl]-11H-indolo[3,2-c]isoquinolin-5-one
IUPAC NAME: 8-chloro-6-[2-(3-methyl-5-oxo-4H-pyrazol-1-yl)-2-oxoethyl]-11H-indolo[3,2-c]isoquinolin-5-one
SYSTEMATIC NAME: 8-chloranyl-6-[2-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)-2-oxidanylidene-ethyl]-11H-indolo[3,2-c]isoquinolin-5-one
MOLECULAR FORMULA: C21H15ClN4O3
MOLECULAR WEIGHT: 406.8218
SMILES: CC1=NN(C(=O)C1)C(=O)CN2C3=C(C4=CC=CC=C4C2=O)NC5=C3C=C(C=C5)Cl
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Product OPENEYE NAME: methyl 4-[2-[(2,4-dichlorophenyl)methyl]benzoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate
CAS Name: 4-[[2-[(2,4-dichlorophenyl)methyl]phenyl]-oxomethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester
IUPAC NAME: methyl 4-[2-[(2,4-dichlorophenyl)methyl]benzoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate
SYSTEMATIC NAME: methyl 4-[2-[(2,4-dichlorophenyl)methyl]phenyl]carbonyl-2,5-dimethyl-1H-pyrrole-3-carboxylate
MOLECULAR FORMULA: C22H19Cl2NO3
MOLECULAR WEIGHT: 416.29716
SMILES: CC1=C(C(=C(N1)C)C(=O)OC)C(=O)C2=CC=CC=C2CC3=C(C=C(C=C3)Cl)Cl
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Product OPENEYE NAME: methyl 4-[2-(chloromethyl)benzoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate
CAS Name: 4-[[2-(chloromethyl)phenyl]-oxomethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester
IUPAC NAME: methyl 4-[2-(chloromethyl)benzoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate
SYSTEMATIC NAME: methyl 4-[2-(chloromethyl)phenyl]carbonyl-2,5-dimethyl-1H-pyrrole-3-carboxylate
MOLECULAR FORMULA: C16H16ClNO3
MOLECULAR WEIGHT: 305.75614
SMILES: CC1=C(C(=C(N1)C)C(=O)OC)C(=O)C2=CC=CC=C2CCl
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Product OPENEYE NAME: methyl 2,9a-dimethyl-4-oxo-9H-benzo[f]indole-3-carboxylate
CAS Name: 2,9a-dimethyl-4-oxo-9H-benzo[f]indole-3-carboxylic acid methyl ester
IUPAC NAME: methyl 2,9a-dimethyl-4-oxo-9H-benzo[f]indole-3-carboxylate
SYSTEMATIC NAME: methyl 2,9a-dimethyl-4-oxidanylidene-9H-benzo[f]indole-3-carboxylate
MOLECULAR FORMULA: C16H15NO3
MOLECULAR WEIGHT: 269.2952
SMILES: CC1=NC2(CC3=CC=CC=C3C(=O)C2=C1C(=O)OC)C
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Product OPENEYE NAME: 2-(4-chlorobutylsulfanyl)-1H-pyrrole
CAS Name: 2-(4-chlorobutylthio)-1H-pyrrole
IUPAC NAME: 2-(4-chlorobutylsulfanyl)-1H-pyrrole
SYSTEMATIC NAME: 2-(4-chloranylbutylsulfanyl)-1H-pyrrole
MOLECULAR FORMULA: C8H12ClNS
MOLECULAR WEIGHT: 189.70558
SMILES: C1=CNC(=C1)SCCCCCl
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Product OPENEYE NAME: diethyl(1H-pyrrol-2-yl)sulfonium
CAS Name: diethyl(1H-pyrrol-2-yl)sulfonium
IUPAC NAME: diethyl(1H-pyrrol-2-yl)sulfanium
SYSTEMATIC NAME: diethyl(1H-pyrrol-2-yl)sulfanium
MOLECULAR FORMULA: C8H14NS+
MOLECULAR WEIGHT: 156.26846
SMILES: CC[S+](CC)C1=CC=CN1
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Product OPENEYE NAME: 2-tetrahydrothiophen-1-ium-1-yl-1H-pyrrole
CAS Name: 2-(1-thiolan-1-iumyl)-1H-pyrrole
IUPAC NAME: 2-(thiolan-1-ium-1-yl)-1H-pyrrole
SYSTEMATIC NAME: 2-(thiolan-1-ium-1-yl)-1H-pyrrole
MOLECULAR FORMULA: C8H12NS+
MOLECULAR WEIGHT: 154.25258
SMILES: C1CC[S+](C1)C2=CC=CN2
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Product OPENEYE NAME: dibutyl(1H-pyrrol-2-yl)sulfonium
CAS Name: dibutyl(1H-pyrrol-2-yl)sulfonium
IUPAC NAME: dibutyl(1H-pyrrol-2-yl)sulfanium
SYSTEMATIC NAME: dibutyl(1H-pyrrol-2-yl)sulfanium
MOLECULAR FORMULA: C12H22NS+
MOLECULAR WEIGHT: 212.37478
SMILES: CCCC[S+](CCCC)C1=CC=CN1
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Product OPENEYE NAME: diethyl-(1-methylpyrrol-2-yl)sulfonium
CAS Name: diethyl-(1-methyl-2-pyrrolyl)sulfonium
IUPAC NAME: diethyl-(1-methylpyrrol-2-yl)sulfanium
SYSTEMATIC NAME: diethyl-(1-methylpyrrol-2-yl)sulfanium
MOLECULAR FORMULA: C9H16NS+
MOLECULAR WEIGHT: 170.29504
SMILES: CC[S+](CC)C1=CC=CN1C
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Product OPENEYE NAME: 1-methyl-2-tetrahydrothiophen-1-ium-1-yl-pyrrole
CAS Name: 1-methyl-2-(1-thiolan-1-iumyl)pyrrole
IUPAC NAME: 1-methyl-2-(thiolan-1-ium-1-yl)pyrrole
SYSTEMATIC NAME: 1-methyl-2-(thiolan-1-ium-1-yl)pyrrole
MOLECULAR FORMULA: C9H14NS+
MOLECULAR WEIGHT: 168.27916
SMILES: CN1C=CC=C1[S+]2CCCC2
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Product OPENEYE NAME: dibutyl-(1-methylpyrrol-2-yl)sulfonium
CAS Name: dibutyl-(1-methyl-2-pyrrolyl)sulfonium
IUPAC NAME: dibutyl-(1-methylpyrrol-2-yl)sulfanium
SYSTEMATIC NAME: dibutyl-(1-methylpyrrol-2-yl)sulfanium
MOLECULAR FORMULA: C13H24NS+
MOLECULAR WEIGHT: 226.40136
SMILES: CCCC[S+](CCCC)C1=CC=CN1C
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Product OPENEYE NAME: (2,5-dimethyl-1H-pyrrol-3-yl)-dimethyl-sulfonium
CAS Name: (2,5-dimethyl-1H-pyrrol-3-yl)-dimethylsulfonium
IUPAC NAME: (2,5-dimethyl-1H-pyrrol-3-yl)-dimethylsulfanium
SYSTEMATIC NAME: (2,5-dimethyl-1H-pyrrol-3-yl)-dimethyl-sulfanium
MOLECULAR FORMULA: C8H14NS+
MOLECULAR WEIGHT: 156.26846
SMILES: CC1=CC(=C(N1)C)[S+](C)C
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Product OPENEYE NAME: (2,5-dimethyl-1H-pyrrol-3-yl)-diethyl-sulfonium
CAS Name: (2,5-dimethyl-1H-pyrrol-3-yl)-diethylsulfonium
IUPAC NAME: (2,5-dimethyl-1H-pyrrol-3-yl)-diethylsulfanium
SYSTEMATIC NAME: (2,5-dimethyl-1H-pyrrol-3-yl)-diethyl-sulfanium
MOLECULAR FORMULA: C10H18NS+
MOLECULAR WEIGHT: 184.32162
SMILES: CC[S+](CC)C1=C(NC(=C1)C)C
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Product OPENEYE NAME: 2,5-dimethyl-3-tetrahydrothiophen-1-ium-1-yl-1H-pyrrole
CAS Name: 2,5-dimethyl-3-(1-thiolan-1-iumyl)-1H-pyrrole
IUPAC NAME: 2,5-dimethyl-3-(thiolan-1-ium-1-yl)-1H-pyrrole
SYSTEMATIC NAME: 2,5-dimethyl-3-(thiolan-1-ium-1-yl)-1H-pyrrole
MOLECULAR FORMULA: C10H16NS+
MOLECULAR WEIGHT: 182.30574
SMILES: CC1=CC(=C(N1)C)[S+]2CCCC2
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Product OPENEYE NAME: dibutyl-(2,5-dimethyl-1H-pyrrol-3-yl)sulfonium
CAS Name: dibutyl-(2,5-dimethyl-1H-pyrrol-3-yl)sulfonium
IUPAC NAME: dibutyl-(2,5-dimethyl-1H-pyrrol-3-yl)sulfanium
SYSTEMATIC NAME: dibutyl-(2,5-dimethyl-1H-pyrrol-3-yl)sulfanium
MOLECULAR FORMULA: C14H26NS+
MOLECULAR WEIGHT: 240.42794
SMILES: CCCC[S+](CCCC)C1=C(NC(=C1)C)C
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Product OPENEYE NAME: dimethyl-(1,2,5-trimethylpyrrol-3-yl)sulfonium
CAS Name: dimethyl-(1,2,5-trimethyl-3-pyrrolyl)sulfonium
IUPAC NAME: dimethyl-(1,2,5-trimethylpyrrol-3-yl)sulfanium
SYSTEMATIC NAME: dimethyl-(1,2,5-trimethylpyrrol-3-yl)sulfanium
MOLECULAR FORMULA: C9H16NS+
MOLECULAR WEIGHT: 170.29504
SMILES: CC1=CC(=C(N1C)C)[S+](C)C
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Product OPENEYE NAME: diethyl-(1,2,5-trimethylpyrrol-3-yl)sulfonium
CAS Name: diethyl-(1,2,5-trimethyl-3-pyrrolyl)sulfonium
IUPAC NAME: diethyl-(1,2,5-trimethylpyrrol-3-yl)sulfanium
SYSTEMATIC NAME: diethyl-(1,2,5-trimethylpyrrol-3-yl)sulfanium
MOLECULAR FORMULA: C11H20NS+
MOLECULAR WEIGHT: 198.3482
SMILES: CC[S+](CC)C1=C(N(C(=C1)C)C)C
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