Tuesday, August 6, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2-fluoro-7-methylsulfonyl-spiro[fluorene-9,4'-imidazolidine]
CAS Name: 2-fluoro-7-methylsulfonylspiro[fluorene-9,4'-imidazolidine]
IUPAC NAME: 2-fluoro-7-methylsulfonylspiro[fluorene-9,4'-imidazolidine]
SYSTEMATIC NAME: 2-fluoranyl-7-methylsulfonyl-spiro[fluorene-9,4'-imidazolidine]
MOLECULAR FORMULA: C16H15FN2O2S
MOLECULAR WEIGHT: 318.365903
SMILES: CS(=O)(=O)C1=CC2=C(C=C1)C3=C(C24CNCN4)C=C(C=C3)F
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Product OPENEYE NAME: 2-methylsulfonylspiro[fluorene-9,4'-imidazolidine]
CAS Name: 2-methylsulfonylspiro[fluorene-9,4'-imidazolidine]
IUPAC NAME: 2-methylsulfonylspiro[fluorene-9,4'-imidazolidine]
SYSTEMATIC NAME: 2-methylsulfonylspiro[fluorene-9,4'-imidazolidine]
MOLECULAR FORMULA: C16H16N2O2S
MOLECULAR WEIGHT: 300.37544
SMILES: CS(=O)(=O)C1=CC2=C(C=C1)C3=CC=CC=C3C24CNCN4
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Product OPENEYE NAME: 4-ethoxy-9-methoxy-7-(methylsulfinylmethyl)furo[3,2-g]chromen-5-one
CAS Name: 4-ethoxy-9-methoxy-7-(methylsulfinylmethyl)-5-furo[3,2-g][1]benzopyranone
IUPAC NAME: 4-ethoxy-9-methoxy-7-(methylsulfinylmethyl)furo[3,2-g]chromen-5-one
SYSTEMATIC NAME: 4-ethoxy-9-methoxy-7-(methylsulfinylmethyl)furo[3,2-g]chromen-5-one
MOLECULAR FORMULA: C16H16O6S
MOLECULAR WEIGHT: 336.35964
SMILES: CCOC1=C2C(=O)C=C(OC2=C(C3=C1C=CO3)OC)CS(=O)C
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Product OPENEYE NAME: 7H-furo[3,2-g]chromene
CAS Name: 7H-furo[3,2-g][1]benzopyran
IUPAC NAME: 7H-furo[3,2-g]chromene
SYSTEMATIC NAME: 7H-furo[3,2-g]chromene
MOLECULAR FORMULA: C11H8O2
MOLECULAR WEIGHT: 172.18002
SMILES: C1C=CC2=C(O1)C=C3C(=C2)C=CO3
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Product OPENEYE NAME: (4,9-dimethoxy-5-oxo-furo[3,2-g]chromen-7-yl)methyl 2-methylsulfanylacetate
CAS Name: 2-(methylthio)acetic acid (4,9-dimethoxy-5-oxo-7-furo[3,2-g][1]benzopyranyl)methyl ester
IUPAC NAME: (4,9-dimethoxy-5-oxofuro[3,2-g]chromen-7-yl)methyl 2-methylsulfanylacetate
SYSTEMATIC NAME: (4,9-dimethoxy-5-oxidanylidene-furo[3,2-g]chromen-7-yl)methyl 2-methylsulfanylethanoate
MOLECULAR FORMULA: C17H16O7S
MOLECULAR WEIGHT: 364.36974
SMILES: COC1=C2C(=O)C=C(OC2=C(C3=C1C=CO3)OC)COC(=O)CSC
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Product OPENEYE NAME: [1-methyl-2-(2-methylprop-2-enoylamino)ethyl] 2-cyanoacetate
CAS Name: 2-cyanoacetic acid 1-[(2-methyl-1-oxoprop-2-enyl)amino]propan-2-yl ester
IUPAC NAME: 1-(2-methylprop-2-enoylamino)propan-2-yl 2-cyanoacetate
SYSTEMATIC NAME: 1-(2-methylprop-2-enoylamino)propan-2-yl 2-cyanoethanoate
MOLECULAR FORMULA: C10H14N2O3
MOLECULAR WEIGHT: 210.22976
SMILES: CC(CNC(=O)C(=C)C)OC(=O)CC#N
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Product OPENEYE NAME: 2-[4-(1,4,4a,8a-tetrahydronaphthalen-2-yl)butyl]-1,4,4a,8a-tetrahydronaphthalene
CAS Name: 2-[4-(1,4,4a,8a-tetrahydronaphthalen-2-yl)butyl]-1,4,4a,8a-tetrahydronaphthalene
IUPAC NAME: 2-[4-(1,4,4a,8a-tetrahydronaphthalen-2-yl)butyl]-1,4,4a,8a-tetrahydronaphthalene
SYSTEMATIC NAME: 2-[4-(1,4,4a,8a-tetrahydronaphthalen-2-yl)butyl]-1,4,4a,8a-tetrahydronaphthalene
MOLECULAR FORMULA: C24H30
MOLECULAR WEIGHT: 318.495
SMILES: C1C=C(CC2C1C=CC=C2)CCCCC3=CCC4C=CC=CC4C3
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Product OPENEYE NAME: 7-isopropylidenebicyclo[4.1.0]hepta-1,3,5-triene
CAS Name: 7-propan-2-ylidenebicyclo[4.1.0]hepta-1,3,5-triene
IUPAC NAME: 7-propan-2-ylidenebicyclo[4.1.0]hepta-1,3,5-triene
SYSTEMATIC NAME: 7-propan-2-ylidenebicyclo[4.1.0]hepta-1,3,5-triene
MOLECULAR FORMULA: C10H10
MOLECULAR WEIGHT: 130.1864
SMILES: CC(=C1C2=CC=CC=C21)C
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Product OPENEYE NAME: 1,2-dihexylnaphthalene
CAS Name: 1,2-dihexylnaphthalene
IUPAC NAME: 1,2-dihexylnaphthalene
SYSTEMATIC NAME: 1,2-dihexylnaphthalene
MOLECULAR FORMULA: C22H32
MOLECULAR WEIGHT: 296.48948
SMILES: CCCCCCC1=C(C2=CC=CC=C2C=C1)CCCCCC
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Product OPENEYE NAME: N-[5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]-3-(prop-2-enoylamino)benzamide
CAS Name: 3-(1-oxoprop-2-enylamino)-N-[5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]benzamide
IUPAC NAME: N-[5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]-3-(prop-2-enoylamino)benzamide
SYSTEMATIC NAME: N-[5-oxidanylidene-1-[2,4,6-tris(chloranyl)phenyl]-4H-pyrazol-3-yl]-3-(prop-2-enoylamino)benzamide
MOLECULAR FORMULA: C19H13Cl3N4O3
MOLECULAR WEIGHT: 451.69052
SMILES: C=CC(=O)NC1=CC=CC(=C1)C(=O)NC2=NN(C(=O)C2)C3=C(C=C(C=C3Cl)Cl)Cl
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Product OPENEYE NAME: N-hydroxy-N-[2-[2-(prop-2-enoylamino)phenyl]ethyl]naphthalene-2-carboxamide
CAS Name: N-hydroxy-N-[2-[2-(1-oxoprop-2-enylamino)phenyl]ethyl]-2-naphthalenecarboxamide
IUPAC NAME: N-hydroxy-N-[2-[2-(prop-2-enoylamino)phenyl]ethyl]naphthalene-2-carboxamide
SYSTEMATIC NAME: N-oxidanyl-N-[2-[2-(prop-2-enoylamino)phenyl]ethyl]naphthalene-2-carboxamide
MOLECULAR FORMULA: C22H20N2O3
MOLECULAR WEIGHT: 360.4058
SMILES: C=CC(=O)NC1=CC=CC=C1CCN(C(=O)C2=CC3=CC=CC=C3C=C2)O
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Product OPENEYE NAME: 1-piperazin-1-ylbutane-1,3-dione hydrobromide
CAS Name: 1-(1-piperazinyl)butane-1,3-dione hydrobromide
IUPAC NAME: 1-piperazin-1-ylbutane-1,3-dione hydrobromide
SYSTEMATIC NAME: 1-piperazin-1-ylbutane-1,3-dione hydrobromide
MOLECULAR FORMULA: C8H15BrN2O2
MOLECULAR WEIGHT: 251.1209
SMILES: CC(=O)CC(=O)N1CCNCC1.Br
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Product OPENEYE NAME: 1-piperazin-1-ylbutane-1,3-dione
CAS Name: 1-(1-piperazinyl)butane-1,3-dione
IUPAC NAME: 1-piperazin-1-ylbutane-1,3-dione
SYSTEMATIC NAME: 1-piperazin-1-ylbutane-1,3-dione
MOLECULAR FORMULA: C8H14N2O2
MOLECULAR WEIGHT: 170.20896
SMILES: CC(=O)CC(=O)N1CCNCC1
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Product OPENEYE NAME: N-(2-aminoethyl)-3-oxo-butanamide hydrobromide
CAS Name: N-(2-aminoethyl)-3-oxobutanamide hydrobromide
IUPAC NAME: N-(2-aminoethyl)-3-oxobutanamide hydrobromide
SYSTEMATIC NAME: N-(2-azanylethyl)-3-oxidanylidene-butanamide hydrobromide
MOLECULAR FORMULA: C6H13BrN2O2
MOLECULAR WEIGHT: 225.08362
SMILES: CC(=O)CC(=O)NCCN.Br
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Product OPENEYE NAME: benzyl N-[2-(3-oxobutanoylamino)ethyl]carbamate
CAS Name: N-[2-(1,3-dioxobutylamino)ethyl]carbamic acid (phenylmethyl) ester
IUPAC NAME: benzyl N-[2-(3-oxobutanoylamino)ethyl]carbamate
SYSTEMATIC NAME: (phenylmethyl) N-[2-(3-oxidanylidenebutanoylamino)ethyl]carbamate
MOLECULAR FORMULA: C14H18N2O4
MOLECULAR WEIGHT: 278.30372
SMILES: CC(=O)CC(=O)NCCNC(=O)OCC1=CC=CC=C1
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