Wednesday, July 3, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 6-methoxy-N2,N2,N4,N4-tetrakis(phenylsulfanyl)-1,3,5-triazine-2,4-diamine
CAS Name: N-[4-[bis(phenylthio)amino]-6-methoxy-1,3,5-triazin-2-yl]-N-(phenylthio)benzenesulfenamide
IUPAC NAME: 6-methoxy-2-N,2-N,4-N,4-N-tetrakis(phenylsulfanyl)-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: 6-methoxy-N2,N2,N4,N4-tetrakis(phenylsulfanyl)-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C28H23N5OS4
MOLECULAR WEIGHT: 573.77512
SMILES: COC1=NC(=NC(=N1)N(SC2=CC=CC=C2)SC3=CC=CC=C3)N(SC4=CC=CC=C4)SC5=CC=CC=C5
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Product OPENEYE NAME: N2,N2,N6,4-tetrakis(benzylsulfanyl)-4-methyl-1H-1,3,5-triazine-2,6-diamine
CAS Name: N-[6-[bis(phenylmethylthio)amino]-4-methyl-4-(phenylmethylthio)-1H-1,3,5-triazin-2-yl]-1-phenylmethanesulfenamide
IUPAC NAME: 2-N,2-N,6-N,4-tetrakis(benzylsulfanyl)-4-methyl-1H-1,3,5-triazine-2,6-diamine
SYSTEMATIC NAME: 4-methyl-N2,N2,N6,4-tetrakis(phenylmethylsulfanyl)-1H-1,3,5-triazine-2,6-diamine
MOLECULAR FORMULA: C32H33N5S4
MOLECULAR WEIGHT: 615.89792
SMILES: CC1(N=C(NC(=N1)N(SCC2=CC=CC=C2)SCC3=CC=CC=C3)NSCC4=CC=CC=C4)SCC5=CC=CC=C5
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Product OPENEYE NAME: N2,N2,N4,6-tetrakis(1-phenylethylsulfanyl)-1,3,5-triazine-2,4-diamine
CAS Name: N-[4-[bis(1-phenylethylthio)amino]-6-(1-phenylethylthio)-1,3,5-triazin-2-yl]-1-phenylethanesulfenamide
IUPAC NAME: 2-N,2-N,4-N,6-tetrakis(1-phenylethylsulfanyl)-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: N2,N2,N4,6-tetrakis(1-phenylethylsulfanyl)-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C35H37N5S4
MOLECULAR WEIGHT: 655.96178
SMILES: CC(C1=CC=CC=C1)SC2=NC(=NC(=N2)N(SC(C)C3=CC=CC=C3)SC(C)C4=CC=CC=C4)NSC(C)C5=CC=CC=C5
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Product OPENEYE NAME: 4-chloro-N2,N2,N6,4-tetrakis(1-phenylethylsulfanyl)-1H-1,3,5-triazine-2,6-diamine
CAS Name: N-[6-[bis(1-phenylethylthio)amino]-4-chloro-4-(1-phenylethylthio)-1H-1,3,5-triazin-2-yl]-1-phenylethanesulfenamide
IUPAC NAME: 4-chloro-2-N,2-N,6-N,4-tetrakis(1-phenylethylsulfanyl)-1H-1,3,5-triazine-2,6-diamine
SYSTEMATIC NAME: 4-chloranyl-N2,N2,N6,4-tetrakis(1-phenylethylsulfanyl)-1H-1,3,5-triazine-2,6-diamine
MOLECULAR FORMULA: C35H38ClN5S4
MOLECULAR WEIGHT: 692.42272
SMILES: CC(C1=CC=CC=C1)SC2(N=C(NC(=N2)N(SC(C)C3=CC=CC=C3)SC(C)C4=CC=CC=C4)NSC(C)C5=CC=CC=C5)Cl
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Product OPENEYE NAME: N-(3-methoxyphenyl)-1-phenyl-pyrazolo[3,4-b]pyrazin-5-amine
CAS Name: N-(3-methoxyphenyl)-1-phenyl-5-pyrazolo[3,4-b]pyrazinamine
IUPAC NAME: N-(3-methoxyphenyl)-1-phenylpyrazolo[3,4-b]pyrazin-5-amine
SYSTEMATIC NAME: N-(3-methoxyphenyl)-1-phenyl-pyrazolo[3,4-b]pyrazin-5-amine
MOLECULAR FORMULA: C18H15N5O
MOLECULAR WEIGHT: 317.3446
SMILES: COC1=CC=CC(=C1)NC2=CN=C3C(=N2)C=NN3C4=CC=CC=C4
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Product OPENEYE NAME: 1-(3-chlorophenyl)pyrazolo[3,4-b]pyrazine
CAS Name: 1-(3-chlorophenyl)pyrazolo[3,4-b]pyrazine
IUPAC NAME: 1-(3-chlorophenyl)pyrazolo[3,4-b]pyrazine
SYSTEMATIC NAME: 1-(3-chlorophenyl)pyrazolo[3,4-b]pyrazine
MOLECULAR FORMULA: C11H7ClN4
MOLECULAR WEIGHT: 230.65308
SMILES: C1=CC(=CC(=C1)Cl)N2C3=NC=CN=C3C=N2
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Product OPENEYE NAME: 1-phenyl-N-(p-tolyl)pyrazolo[3,4-b]pyrazin-5-amine
CAS Name: N-(4-methylphenyl)-1-phenyl-5-pyrazolo[3,4-b]pyrazinamine
IUPAC NAME: N-(4-methylphenyl)-1-phenylpyrazolo[3,4-b]pyrazin-5-amine
SYSTEMATIC NAME: N-(4-methylphenyl)-1-phenyl-pyrazolo[3,4-b]pyrazin-5-amine
MOLECULAR FORMULA: C18H15N5
MOLECULAR WEIGHT: 301.3452
SMILES: CC1=CC=C(C=C1)NC2=CN=C3C(=N2)C=NN3C4=CC=CC=C4
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Product OPENEYE NAME: N-cyclohexyl-1-phenyl-pyrazolo[3,4-b]pyrazin-5-amine
CAS Name: N-cyclohexyl-1-phenyl-5-pyrazolo[3,4-b]pyrazinamine
IUPAC NAME: N-cyclohexyl-1-phenylpyrazolo[3,4-b]pyrazin-5-amine
SYSTEMATIC NAME: N-cyclohexyl-1-phenyl-pyrazolo[3,4-b]pyrazin-5-amine
MOLECULAR FORMULA: C17H19N5
MOLECULAR WEIGHT: 293.36626
SMILES: C1CCC(CC1)NC2=CN=C3C(=N2)C=NN3C4=CC=CC=C4
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Product OPENEYE NAME: 4-nitroso-2-phenyl-pyrazol-3-amine hydrochloride
CAS Name: 4-nitroso-2-phenyl-3-pyrazolamine hydrochloride
IUPAC NAME: 4-nitroso-2-phenylpyrazol-3-amine hydrochloride
SYSTEMATIC NAME: 4-nitroso-2-phenyl-pyrazol-3-amine hydrochloride
MOLECULAR FORMULA: C9H9ClN4O
MOLECULAR WEIGHT: 224.64696
SMILES: C1=CC=C(C=C1)N2C(=C(C=N2)N=O)N.Cl
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Product OPENEYE NAME: N-(3-ethoxyphenyl)-1-phenyl-pyrazolo[3,4-b]pyrazin-5-amine
CAS Name: N-(3-ethoxyphenyl)-1-phenyl-5-pyrazolo[3,4-b]pyrazinamine
IUPAC NAME: N-(3-ethoxyphenyl)-1-phenylpyrazolo[3,4-b]pyrazin-5-amine
SYSTEMATIC NAME: N-(3-ethoxyphenyl)-1-phenyl-pyrazolo[3,4-b]pyrazin-5-amine
MOLECULAR FORMULA: C19H17N5O
MOLECULAR WEIGHT: 331.37118
SMILES: CCOC1=CC=CC(=C1)NC2=CN=C3C(=N2)C=NN3C4=CC=CC=C4
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Product OPENEYE NAME: N-(4-methoxyphenyl)-1-phenyl-pyrazolo[3,4-b]pyrazin-5-amine
CAS Name: N-(4-methoxyphenyl)-1-phenyl-5-pyrazolo[3,4-b]pyrazinamine
IUPAC NAME: N-(4-methoxyphenyl)-1-phenylpyrazolo[3,4-b]pyrazin-5-amine
SYSTEMATIC NAME: N-(4-methoxyphenyl)-1-phenyl-pyrazolo[3,4-b]pyrazin-5-amine
MOLECULAR FORMULA: C18H15N5O
MOLECULAR WEIGHT: 317.3446
SMILES: COC1=CC=C(C=C1)NC2=CN=C3C(=N2)C=NN3C4=CC=CC=C4
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Product OPENEYE NAME: 1-[(3-amino-2-pyridyl)methyl]-4-[[4-(pyrimidin-2-ylamino)phenyl]methyl]piperazine-2,3-dione
CAS Name: 1-[(3-amino-2-pyridinyl)methyl]-4-[[4-(2-pyrimidinylamino)phenyl]methyl]piperazine-2,3-dione
IUPAC NAME: 1-[(3-aminopyridin-2-yl)methyl]-4-[[4-(pyrimidin-2-ylamino)phenyl]methyl]piperazine-2,3-dione
SYSTEMATIC NAME: 1-[(3-azanylpyridin-2-yl)methyl]-4-[[4-(pyrimidin-2-ylamino)phenyl]methyl]piperazine-2,3-dione
MOLECULAR FORMULA: C21H21N7O2
MOLECULAR WEIGHT: 403.43714
SMILES: C1CN(C(=O)C(=O)N1CC2=CC=C(C=C2)NC3=NC=CC=N3)CC4=C(C=CC=N4)N
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Product OPENEYE NAME: [4-[(1-hexyl-2,4-dioxo-piperazine-1,4-diium-1-yl)methyl]phenyl]thiourea
CAS Name: [4-[(1-hexyl-2,4-dioxo-1-piperazine-1,4-diiumyl)methyl]phenyl]thiourea
IUPAC NAME: [4-[(1-hexyl-2,4-dioxopiperazine-1,4-diium-1-yl)methyl]phenyl]thiourea
SYSTEMATIC NAME: 1-[4-[[1-hexyl-2,4-bis(oxidanylidene)piperazine-1,4-diium-1-yl]methyl]phenyl]thiourea
MOLECULAR FORMULA: C18H28N4O2S+2
MOLECULAR WEIGHT: 364.50552
SMILES: CCCCCC[N+]1(CC[N+](=O)CC1=O)CC2=CC=C(C=C2)NC(=S)N
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Product OPENEYE NAME: 1-hexyl-1-[[4-(imidazolidin-2-ylamino)phenyl]methyl]-4-oxo-piperazine-1,4-diium-2-one
CAS Name: 1-hexyl-1-[[4-(2-imidazolidinylamino)phenyl]methyl]-4-oxo-2-piperazine-1,4-diiumone
IUPAC NAME: 1-hexyl-1-[[4-(imidazolidin-2-ylamino)phenyl]methyl]-4-oxopiperazine-1,4-diium-2-one
SYSTEMATIC NAME: 1-hexyl-1-[[4-(imidazolidin-2-ylamino)phenyl]methyl]-4-oxidanylidene-piperazine-1,4-diium-2-one
MOLECULAR FORMULA: C20H33N5O2+2
MOLECULAR WEIGHT: 375.50832
SMILES: CCCCCC[N+]1(CC[N+](=O)CC1=O)CC2=CC=C(C=C2)NC3NCCN3
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Product OPENEYE NAME: 2-(2-benzoylsulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid
CAS Name: 2-[2-(benzoylthio)-1-oxopropyl]-3,4-dihydro-1H-isoquinoline-1-carboxylic acid
IUPAC NAME: 2-(2-benzoylsulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid
SYSTEMATIC NAME: 2-[2-(phenylcarbonylsulfanyl)propanoyl]-3,4-dihydro-1H-isoquinoline-1-carboxylic acid
MOLECULAR FORMULA: C20H19NO4S
MOLECULAR WEIGHT: 369.43416
SMILES: CC(C(=O)N1CCC2=CC=CC=C2C1C(=O)O)SC(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-(2-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid
CAS Name: 2-(2-mercapto-1-oxopropyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid
IUPAC NAME: 2-(2-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid
SYSTEMATIC NAME: 2-(2-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid
MOLECULAR FORMULA: C13H15NO3S
MOLECULAR WEIGHT: 265.3281
SMILES: CC(C(=O)N1CCC2=CC=CC=C2C1C(=O)O)S
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Product OPENEYE NAME: 2-[5-(1-carboxyethyl)-3,3-dimethyl-2-(4-pyridyl)indol-4-yl]octanoic acid
CAS Name: 2-[5-(1-carboxyethyl)-3,3-dimethyl-2-pyridin-4-yl-4-indolyl]octanoic acid
IUPAC NAME: 2-[5-(1-carboxyethyl)-3,3-dimethyl-2-pyridin-4-ylindol-4-yl]octanoic acid
SYSTEMATIC NAME: 2-[3,3-dimethyl-5-(1-oxidanyl-1-oxidanylidene-propan-2-yl)-2-pyridin-4-yl-indol-4-yl]octanoic acid
MOLECULAR FORMULA: C26H32N2O4
MOLECULAR WEIGHT: 436.54328
SMILES: CCCCCCC(C1=C(C=CC2=C1C(C(=N2)C3=CC=NC=C3)(C)C)C(C)C(=O)O)C(=O)O
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Product OPENEYE NAME: 5-chloro-1-(2-ethylhexyl)-N-(4-methyl-1-piperidyl)-2H-pyridin-6-amine
CAS Name: 5-chloro-1-(2-ethylhexyl)-N-(4-methyl-1-piperidinyl)-2H-pyridin-6-amine
IUPAC NAME: 5-chloro-1-(2-ethylhexyl)-N-(4-methylpiperidin-1-yl)-2H-pyridin-6-amine
SYSTEMATIC NAME: 5-chloranyl-1-(2-ethylhexyl)-N-(4-methylpiperidin-1-yl)-2H-pyridin-6-amine
MOLECULAR FORMULA: C19H34ClN3
MOLECULAR WEIGHT: 339.94636
SMILES: CCCCC(CC)CN1CC=CC(=C1NN2CCC(CC2)C)Cl
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Product OPENEYE NAME: 1-(2-ethylhexyl)pyridin-1-ium
CAS Name: 1-(2-ethylhexyl)pyridin-1-ium
IUPAC NAME: 1-(2-ethylhexyl)pyridin-1-ium
SYSTEMATIC NAME: 1-(2-ethylhexyl)pyridin-1-ium
MOLECULAR FORMULA: C13H22N+
MOLECULAR WEIGHT: 192.32048
SMILES: CCCCC(CC)C[N+]1=CC=CC=C1
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Product OPENEYE NAME: 5-chloro-1-(2-ethylhexyl)-N,N-dihexyl-2H-pyridin-6-amine
CAS Name: 5-chloro-1-(2-ethylhexyl)-N,N-dihexyl-2H-pyridin-6-amine
IUPAC NAME: 5-chloro-1-(2-ethylhexyl)-N,N-dihexyl-2H-pyridin-6-amine
SYSTEMATIC NAME: 5-chloranyl-1-(2-ethylhexyl)-N,N-dihexyl-2H-pyridin-6-amine
MOLECULAR FORMULA: C25H47ClN2
MOLECULAR WEIGHT: 411.10708
SMILES: CCCCCCN(CCCCCC)C1=C(C=CCN1CC(CC)CCCC)Cl
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Product OPENEYE NAME: N-(4-methyl-1-piperidyl)pyridin-2-amine
CAS Name: N-(4-methyl-1-piperidinyl)-2-pyridinamine
IUPAC NAME: N-(4-methylpiperidin-1-yl)pyridin-2-amine
SYSTEMATIC NAME: N-(4-methylpiperidin-1-yl)pyridin-2-amine
MOLECULAR FORMULA: C11H17N3
MOLECULAR WEIGHT: 191.27278
SMILES: CC1CCN(CC1)NC2=CC=CC=N2
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Product OPENEYE NAME: 2-(8-chloro-6-phenyl-4H-pyrazolo[3,4-d][2]benzazepin-3-yl)acetic acid
CAS Name: 2-(8-chloro-6-phenyl-4H-pyrazolo[3,4-d][2]benzazepin-3-yl)acetic acid
IUPAC NAME: 2-(8-chloro-6-phenyl-4H-pyrazolo[3,4-d][2]benzazepin-3-yl)acetic acid
SYSTEMATIC NAME: 2-(8-chloranyl-6-phenyl-4H-pyrazolo[3,4-d][2]benzazepin-3-yl)ethanoic acid
MOLECULAR FORMULA: C19H14ClN3O2
MOLECULAR WEIGHT: 351.78636
SMILES: C1C2=C(C=NN2CC(=O)O)C3=C(C=C(C=C3)Cl)C(=N1)C4=CC=CC=C4
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