Saturday, June 29, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-[2-[(5-methyl-1H-imidazol-2-yl)methylsulfanyl]ethyl]-1,1-dioxo-2,5-dihydro-1,2,4-thiadiazol-3-amine
CAS Name: N-[2-[(5-methyl-1H-imidazol-2-yl)methylthio]ethyl]-1,1-dioxo-2,5-dihydro-1,2,4-thiadiazol-3-amine
IUPAC NAME: N-[2-[(5-methyl-1H-imidazol-2-yl)methylsulfanyl]ethyl]-1,1-dioxo-2,5-dihydro-1,2,4-thiadiazol-3-amine
SYSTEMATIC NAME: N-[2-[(5-methyl-1H-imidazol-2-yl)methylsulfanyl]ethyl]-1,1-bis(oxidanylidene)-2,5-dihydro-1,2,4-thiadiazol-3-amine
MOLECULAR FORMULA: C9H15N5O2S2
MOLECULAR WEIGHT: 289.3777
SMILES: CC1=CN=C(N1)CSCCNC2=NCS(=O)(=O)N2
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Product OPENEYE NAME: ethyl 3-methylsulfanyl-1,1-dioxo-thiadiazolidine-4-carboxylate
CAS Name: 3-(methylthio)-1,1-dioxo-4-thiadiazolidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 3-methylsulfanyl-1,1-dioxothiadiazolidine-4-carboxylate
SYSTEMATIC NAME: ethyl 3-methylsulfanyl-1,1-bis(oxidanylidene)-1,2,3-thiadiazolidine-4-carboxylate
MOLECULAR FORMULA: C6H12N2O4S2
MOLECULAR WEIGHT: 240.30048
SMILES: CCOC(=O)C1CS(=O)(=O)NN1SC
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Product OPENEYE NAME: 3-[2-(3-piperidylmethyl)phenoxy]propan-1-amine
CAS Name: 3-[2-(3-piperidinylmethyl)phenoxy]-1-propanamine
IUPAC NAME: 3-[2-(piperidin-3-ylmethyl)phenoxy]propan-1-amine
SYSTEMATIC NAME: 3-[2-(piperidin-3-ylmethyl)phenoxy]propan-1-amine
MOLECULAR FORMULA: C15H24N2O
MOLECULAR WEIGHT: 248.36386
SMILES: C1CC(CNC1)CC2=CC=CC=C2OCCCN
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Product OPENEYE NAME: 4,5-dihydrothiadiazole 1,1-dioxide
CAS Name: 4,5-dihydrothiadiazole 1,1-dioxide
IUPAC NAME: 4,5-dihydrothiadiazole 1,1-dioxide
SYSTEMATIC NAME: 4,5-dihydro-1,2,3-thiadiazole 1,1-dioxide
MOLECULAR FORMULA: C2H4N2O2S
MOLECULAR WEIGHT: 120.13036
SMILES: C1CS(=O)(=O)N=N1
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Product OPENEYE NAME: ethyl 3-methylsulfanyl-1,1-dioxo-1,3-thiazolidine-4-carboxylate
CAS Name: 3-(methylthio)-1,1-dioxo-1,3-thiazolidine-4-carboxylic acid ethyl ester
IUPAC NAME: ethyl 3-methylsulfanyl-1,1-dioxo-1,3-thiazolidine-4-carboxylate
SYSTEMATIC NAME: ethyl 3-methylsulfanyl-1,1-bis(oxidanylidene)-1,3-thiazolidine-4-carboxylate
MOLECULAR FORMULA: C7H13NO4S2
MOLECULAR WEIGHT: 239.31242
SMILES: CCOC(=O)C1CS(=O)(=O)CN1SC
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Product OPENEYE NAME: 3-amino-1-[5-[(dimethylamino)methyl]-2-furyl]propane-1-thiol
CAS Name: 3-amino-1-[5-[(dimethylamino)methyl]-2-furanyl]-1-propanethiol
IUPAC NAME: 3-amino-1-[5-[(dimethylamino)methyl]furan-2-yl]propane-1-thiol
SYSTEMATIC NAME: 3-azanyl-1-[5-[(dimethylamino)methyl]furan-2-yl]propane-1-thiol
MOLECULAR FORMULA: C10H18N2OS
MOLECULAR WEIGHT: 214.32772
SMILES: CN(C)CC1=CC=C(O1)C(CCN)S
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Product OPENEYE NAME: 2-amino-1H-pyridin-2-ol
CAS Name: 2-amino-1H-pyridin-2-ol
IUPAC NAME: 2-amino-1H-pyridin-2-ol
SYSTEMATIC NAME: 2-azanyl-1H-pyridin-2-ol
MOLECULAR FORMULA: C5H8N2O
MOLECULAR WEIGHT: 112.12982
SMILES: C1=CC(NC=C1)(N)O
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Product OPENEYE NAME: N-[3-[(2-amino-4-pyridyl)oxy]propyl]-1,1-dioxo-1,2-benzothiazol-3-amine
CAS Name: N-[3-[(2-amino-4-pyridinyl)oxy]propyl]-1,1-dioxo-1,2-benzothiazol-3-amine
IUPAC NAME: N-[3-(2-aminopyridin-4-yl)oxypropyl]-1,1-dioxo-1,2-benzothiazol-3-amine
SYSTEMATIC NAME: N-[3-(2-azanylpyridin-4-yl)oxypropyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine
MOLECULAR FORMULA: C15H16N4O3S
MOLECULAR WEIGHT: 332.37754
SMILES: C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCCOC3=CC(=NC=C3)N
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Product OPENEYE NAME: methyl 2-chloro-3-[4-[1-(2-oxocyclohexyl)ethoxy]phenyl]propanoate
CAS Name: 2-chloro-3-[4-[1-(2-oxocyclohexyl)ethoxy]phenyl]propanoic acid methyl ester
IUPAC NAME: methyl 2-chloro-3-[4-[1-(2-oxocyclohexyl)ethoxy]phenyl]propanoate
SYSTEMATIC NAME: methyl 2-chloranyl-3-[4-[1-(2-oxidanylidenecyclohexyl)ethoxy]phenyl]propanoate
MOLECULAR FORMULA: C18H23ClO4
MOLECULAR WEIGHT: 338.82582
SMILES: CC(C1CCCCC1=O)OC2=CC=C(C=C2)CC(C(=O)OC)Cl
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Product OPENEYE NAME: 5-[[4-[1-(3-oxocyclohexyl)ethoxy]phenyl]methyl]thiazolidine-2,4-dione
CAS Name: 5-[[4-[1-(3-oxocyclohexyl)ethoxy]phenyl]methyl]thiazolidine-2,4-dione
IUPAC NAME: 5-[[4-[1-(3-oxocyclohexyl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
SYSTEMATIC NAME: 5-[[4-[1-(3-oxidanylidenecyclohexyl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
MOLECULAR FORMULA: C18H21NO4S
MOLECULAR WEIGHT: 347.42864
SMILES: CC(C1CCCC(=O)C1)OC2=CC=C(C=C2)CC3C(=O)NC(=O)S3
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Product OPENEYE NAME: methyl 2-chloro-3-[4-[1-(3-oxocyclohexyl)ethoxy]phenyl]propanoate
CAS Name: 2-chloro-3-[4-[1-(3-oxocyclohexyl)ethoxy]phenyl]propanoic acid methyl ester
IUPAC NAME: methyl 2-chloro-3-[4-[1-(3-oxocyclohexyl)ethoxy]phenyl]propanoate
SYSTEMATIC NAME: methyl 2-chloranyl-3-[4-[1-(3-oxidanylidenecyclohexyl)ethoxy]phenyl]propanoate
MOLECULAR FORMULA: C18H23ClO4
MOLECULAR WEIGHT: 338.82582
SMILES: CC(C1CCCC(=O)C1)OC2=CC=C(C=C2)CC(C(=O)OC)Cl
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Product OPENEYE NAME: methyl 2-chloro-3-[4-[1-(4-oxocyclohexyl)ethoxy]phenyl]propanoate
CAS Name: 2-chloro-3-[4-[1-(4-oxocyclohexyl)ethoxy]phenyl]propanoic acid methyl ester
IUPAC NAME: methyl 2-chloro-3-[4-[1-(4-oxocyclohexyl)ethoxy]phenyl]propanoate
SYSTEMATIC NAME: methyl 2-chloranyl-3-[4-[1-(4-oxidanylidenecyclohexyl)ethoxy]phenyl]propanoate
MOLECULAR FORMULA: C18H23ClO4
MOLECULAR WEIGHT: 338.82582
SMILES: CC(C1CCC(=O)CC1)OC2=CC=C(C=C2)CC(C(=O)OC)Cl
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Product OPENEYE NAME: 5-[[4-[1-(2-oxocyclohexyl)ethoxy]phenyl]methyl]thiazolidine-2,4-dione
CAS Name: 5-[[4-[1-(2-oxocyclohexyl)ethoxy]phenyl]methyl]thiazolidine-2,4-dione
IUPAC NAME: 5-[[4-[1-(2-oxocyclohexyl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
SYSTEMATIC NAME: 5-[[4-[1-(2-oxidanylidenecyclohexyl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
MOLECULAR FORMULA: C18H21NO4S
MOLECULAR WEIGHT: 347.42864
SMILES: CC(C1CCCCC1=O)OC2=CC=C(C=C2)CC3C(=O)NC(=O)S3
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Product OPENEYE NAME: (9-methyl-1,4-dioxaspiro[4.5]decan-9-yl)methanol
CAS Name: (9-methyl-1,4-dioxaspiro[4.5]decan-9-yl)methanol
IUPAC NAME: (9-methyl-1,4-dioxaspiro[4.5]decan-9-yl)methanol
SYSTEMATIC NAME: (9-methyl-1,4-dioxaspiro[4.5]decan-9-yl)methanol
MOLECULAR FORMULA: C10H18O3
MOLECULAR WEIGHT: 186.24812
SMILES: CC1(CCCC2(C1)OCCO2)CO
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Product OPENEYE NAME: 5-[[4-[1-(4-oxocyclohexyl)ethoxy]phenyl]methyl]thiazolidine-2,4-dione
CAS Name: 5-[[4-[1-(4-oxocyclohexyl)ethoxy]phenyl]methyl]thiazolidine-2,4-dione
IUPAC NAME: 5-[[4-[1-(4-oxocyclohexyl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
SYSTEMATIC NAME: 5-[[4-[1-(4-oxidanylidenecyclohexyl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
MOLECULAR FORMULA: C18H21NO4S
MOLECULAR WEIGHT: 347.42864
SMILES: CC(C1CCC(=O)CC1)OC2=CC=C(C=C2)CC3C(=O)NC(=O)S3
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Product OPENEYE NAME: 5-[[4-[1-(3-hydroxycyclohexyl)ethoxy]phenyl]methyl]thiazolidine-2,4-dione
CAS Name: 5-[[4-[1-(3-hydroxycyclohexyl)ethoxy]phenyl]methyl]thiazolidine-2,4-dione
IUPAC NAME: 5-[[4-[1-(3-hydroxycyclohexyl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
SYSTEMATIC NAME: 5-[[4-[1-(3-oxidanylcyclohexyl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
MOLECULAR FORMULA: C18H23NO4S
MOLECULAR WEIGHT: 349.44452
SMILES: CC(C1CCCC(C1)O)OC2=CC=C(C=C2)CC3C(=O)NC(=O)S3
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Product OPENEYE NAME: 5-[[4-[1-(4-hydroxycyclohexyl)ethoxy]phenyl]methyl]thiazolidine-2,4-dione
CAS Name: 5-[[4-[1-(4-hydroxycyclohexyl)ethoxy]phenyl]methyl]thiazolidine-2,4-dione
IUPAC NAME: 5-[[4-[1-(4-hydroxycyclohexyl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
SYSTEMATIC NAME: 5-[[4-[1-(4-oxidanylcyclohexyl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
MOLECULAR FORMULA: C18H23NO4S
MOLECULAR WEIGHT: 349.44452
SMILES: CC(C1CCC(CC1)O)OC2=CC=C(C=C2)CC3C(=O)NC(=O)S3
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Product OPENEYE NAME: N1-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-benzene-1,4-diamine dihydrochloride
CAS Name: N1-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzene-1,4-diamine dihydrochloride
IUPAC NAME: 1-N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzene-1,4-diamine dihydrochloride
SYSTEMATIC NAME: N1-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethyl-benzene-1,4-diamine dihydrochloride
MOLECULAR FORMULA: C13H22Cl2N4
MOLECULAR WEIGHT: 305.24658
SMILES: CCC1=CC(=CC(=C1NC2=NCCN2)CC)N.Cl.Cl
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