Thursday, February 2, 2012

http://ChemLookup.com Compounds




CAS RN: 141358-21-6
CAS Name: 1-[3-[(3-chlorophenyl)thio]phenyl]-N,N-dimethylmethanamine hydrochloride
OPENEYE Name: 1-[3-(3-chlorophenyl)sulfanylphenyl]-N,N-dimethyl-methanamine hydrochloride
IUPAC Name: 1-[3-(3-chlorophenyl)sulfanylphenyl]-N,N-dimethylmethanamine hydrochloride
SYSTEMATIC NAME: 1-[3-(3-chlorophenyl)sulfanylphenyl]-N,N-dimethyl-methanamine hydrochloride
MOLECULAR FORMULA: C15H17Cl2NS
MOLECULAR WEIGHT: 314.27318
SMILES: CN(C)CC1=CC(=CC=C1)SC2=CC(=CC=C2)Cl.Cl
Structure:

CAS RN: 141358-20-5
CAS Name: 3-[[4-[(dimethylamino)methyl]phenyl]thio]phenol hydrochloride
OPENEYE Name: 3-[4-[(dimethylamino)methyl]phenyl]sulfanylphenol hydrochloride
IUPAC Name: 3-[4-[(dimethylamino)methyl]phenyl]sulfanylphenol hydrochloride
SYSTEMATIC NAME: 3-[4-[(dimethylamino)methyl]phenyl]sulfanylphenol hydrochloride
MOLECULAR FORMULA: C15H18ClNOS
MOLECULAR WEIGHT: 295.82752
SMILES: CN(C)CC1=CC=C(C=C1)SC2=CC=CC(=C2)O.Cl
Structure:

CAS RN: 141312-27-8
CAS Name: N-(2-heptoxyphenyl)carbamic acid 2-[4-(phenylmethyl)-1-piperazinyl]ethyl ester dihydrochloride
OPENEYE Name: 2-(4-benzylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
IUPAC Name: 2-(4-benzylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
SYSTEMATIC NAME: 2-[4-(phenylmethyl)piperazin-1-yl]ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
MOLECULAR FORMULA: C27H41Cl2N3O3
MOLECULAR WEIGHT: 526.53874
SMILES: CCCCCCCOC1=CC=CC=C1NC(=O)OCCN2CCN(CC2)CC3=CC=CC=C3.Cl.Cl
Structure:

CAS RN: 141312-26-7
CAS Name: N-(2-heptoxyphenyl)carbamic acid 2-[4-(2-methylpropyl)-1-piperazinyl]ethyl ester dihydrochloride
OPENEYE Name: 2-(4-isobutylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
IUPAC Name: 2-[4-(2-methylpropyl)piperazin-1-yl]ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
SYSTEMATIC NAME: 2-[4-(2-methylpropyl)piperazin-1-yl]ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
MOLECULAR FORMULA: C24H43Cl2N3O3
MOLECULAR WEIGHT: 492.52252
SMILES: CCCCCCCOC1=CC=CC=C1NC(=O)OCCN2CCN(CC2)CC(C)C.Cl.Cl
Structure:

CAS RN: 141312-25-6
CAS Name: N-(2-heptoxyphenyl)carbamic acid 2-(4-prop-2-enyl-1-piperazinyl)ethyl ester dihydrochloride
OPENEYE Name: 2-(4-allylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
IUPAC Name: 2-(4-prop-2-enylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
SYSTEMATIC NAME: 2-(4-prop-2-enylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
MOLECULAR FORMULA: C23H39Cl2N3O3
MOLECULAR WEIGHT: 476.48006
SMILES: CCCCCCCOC1=CC=CC=C1NC(=O)OCCN2CCN(CC2)CC=C.Cl.Cl
Structure:

CAS RN: 141312-24-5
CAS Name: N-(2-heptoxyphenyl)carbamic acid 2-(4-propan-2-yl-1-piperazinyl)ethyl ester dihydrochloride
OPENEYE Name: 2-(4-isopropylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
IUPAC Name: 2-(4-propan-2-ylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
SYSTEMATIC NAME: 2-(4-propan-2-ylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
MOLECULAR FORMULA: C23H41Cl2N3O3
MOLECULAR WEIGHT: 478.49594
SMILES: CCCCCCCOC1=CC=CC=C1NC(=O)OCCN2CCN(CC2)C(C)C.Cl.Cl
Structure:

CAS RN: 141312-23-4
CAS Name: N-(2-heptoxyphenyl)carbamic acid 2-(4-pentyl-1-piperazinyl)ethyl ester dihydrochloride
OPENEYE Name: 2-(4-pentylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
IUPAC Name: 2-(4-pentylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
SYSTEMATIC NAME: 2-(4-pentylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
MOLECULAR FORMULA: C25H45Cl2N3O3
MOLECULAR WEIGHT: 506.5491
SMILES: CCCCCCCOC1=CC=CC=C1NC(=O)OCCN2CCN(CC2)CCCCC.Cl.Cl
Structure:

CAS RN: 141312-22-3
CAS Name: N-(2-heptoxyphenyl)carbamic acid 2-(4-butyl-1-piperazinyl)ethyl ester dihydrochloride
OPENEYE Name: 2-(4-butylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
IUPAC Name: 2-(4-butylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
SYSTEMATIC NAME: 2-(4-butylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
MOLECULAR FORMULA: C24H43Cl2N3O3
MOLECULAR WEIGHT: 492.52252
SMILES: CCCCCCCOC1=CC=CC=C1NC(=O)OCCN2CCN(CC2)CCCC.Cl.Cl
Structure:

CAS RN: 141312-21-2
CAS Name: N-(2-heptoxyphenyl)carbamic acid 2-(4-propyl-1-piperazinyl)ethyl ester dihydrochloride
OPENEYE Name: 2-(4-propylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
IUPAC Name: 2-(4-propylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
SYSTEMATIC NAME: 2-(4-propylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
MOLECULAR FORMULA: C23H41Cl2N3O3
MOLECULAR WEIGHT: 478.49594
SMILES: CCCCCCCOC1=CC=CC=C1NC(=O)OCCN2CCN(CC2)CCC.Cl.Cl
Structure:

CAS RN: 141312-20-1
CAS Name: N-(2-heptoxyphenyl)carbamic acid 2-(4-ethyl-1-piperazinyl)ethyl ester dihydrochloride
OPENEYE Name: 2-(4-ethylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
IUPAC Name: 2-(4-ethylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
SYSTEMATIC NAME: 2-(4-ethylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride
MOLECULAR FORMULA: C22H39Cl2N3O3
MOLECULAR WEIGHT: 464.46936
SMILES: CCCCCCCOC1=CC=CC=C1NC(=O)OCCN2CCN(CC2)CC.Cl.Cl
Structure:

CAS RN: 141300-36-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C13H10N6OS
MOLECULAR WEIGHT: 298.3231
SMILES: COC1=CC=C(C=C1)N2C=NN3C2=NC4=C(C3=S)C=NN4
Structure:

CAS RN: 141300-34-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H7FN6O
MOLECULAR WEIGHT: 270.221983
SMILES: C1=CC(=CC(=C1)F)N2C=NN3C2=NC4=C(C3=O)C=NN4
Structure:

CAS RN: 141300-33-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H7FN6O
MOLECULAR WEIGHT: 270.221983
SMILES: C1=CC(=CC=C1N2C=NN3C2=NC4=C(C3=O)C=NN4)F
Structure:

CAS RN: 141300-32-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H7ClN6O
MOLECULAR WEIGHT: 286.67658
SMILES: C1=CC=C(C(=C1)N2C=NN3C2=NC4=C(C3=O)C=NN4)Cl
Structure:

CAS RN: 141300-31-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H7ClN6O
MOLECULAR WEIGHT: 286.67658
SMILES: C1=CC(=CC=C1N2C=NN3C2=NC4=C(C3=O)C=NN4)Cl
Structure:

CAS RN: 141300-30-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H7BrN6O
MOLECULAR WEIGHT: 331.12758
SMILES: C1=CC(=CC=C1N2C=NN3C2=NC4=C(C3=O)C=NN4)Br
Structure:

CAS RN: 141300-28-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C13H10N6O
MOLECULAR WEIGHT: 266.2581
SMILES: CC1=CC=C(C=C1)N2C=NN3C2=NC4=C(C3=O)C=NN4
Structure:

CAS RN: 141300-27-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H8N6O
MOLECULAR WEIGHT: 252.23152
SMILES: C1=CC=C(C=C1)N2C=NN3C2=NC4=C(C3=O)C=NN4
Structure:

CAS RN: 141300-26-7
CAS Name: 5-amino-6-(4-chloroanilino)-1H-pyrazolo[3,4-d]pyrimidine-4-thione
OPENEYE Name: 5-amino-6-(4-chloroanilino)-1H-pyrazolo[3,4-d]pyrimidine-4-thione
IUPAC Name: 5-amino-6-(4-chloroanilino)-1H-pyrazolo[3,4-d]pyrimidine-4-thione
SYSTEMATIC NAME: 5-azanyl-6-[(4-chlorophenyl)amino]-1H-pyrazolo[3,4-d]pyrimidine-4-thione
MOLECULAR FORMULA: C11H9ClN6S
MOLECULAR WEIGHT: 292.74736
SMILES: C1=CC(=CC=C1NC2=NC3=C(C=NN3)C(=S)N2N)Cl
Structure:

CAS RN: 141300-25-6
CAS Name: 5-amino-6-anilino-1H-pyrazolo[3,4-d]pyrimidine-4-thione
OPENEYE Name: 5-amino-6-anilino-1H-pyrazolo[3,4-d]pyrimidine-4-thione
IUPAC Name: 5-amino-6-anilino-1H-pyrazolo[3,4-d]pyrimidine-4-thione
SYSTEMATIC NAME: 5-azanyl-6-phenylazanyl-1H-pyrazolo[3,4-d]pyrimidine-4-thione
MOLECULAR FORMULA: C11H10N6S
MOLECULAR WEIGHT: 258.3023
SMILES: C1=CC=C(C=C1)NC2=NC3=C(C=NN3)C(=S)N2N
Structure:

CAS RN: 141300-24-5
CAS Name: 5-amino-6-(3-fluoroanilino)-1H-pyrazolo[3,4-d]pyrimidin-4-one
OPENEYE Name: 5-amino-6-(3-fluoroanilino)-1H-pyrazolo[3,4-d]pyrimidin-4-one
IUPAC Name: 5-amino-6-(3-fluoroanilino)-1H-pyrazolo[3,4-d]pyrimidin-4-one
SYSTEMATIC NAME: 5-azanyl-6-[(3-fluorophenyl)amino]-1H-pyrazolo[3,4-d]pyrimidin-4-one
MOLECULAR FORMULA: C11H9FN6O
MOLECULAR WEIGHT: 260.227163
SMILES: C1=CC(=CC(=C1)F)NC2=NC3=C(C=NN3)C(=O)N2N
Structure:

CAS RN: 141300-23-4
CAS Name: 5-amino-6-(4-fluoroanilino)-1H-pyrazolo[3,4-d]pyrimidin-4-one
OPENEYE Name: 5-amino-6-(4-fluoroanilino)-1H-pyrazolo[3,4-d]pyrimidin-4-one
IUPAC Name: 5-amino-6-(4-fluoroanilino)-1H-pyrazolo[3,4-d]pyrimidin-4-one
SYSTEMATIC NAME: 5-azanyl-6-[(4-fluorophenyl)amino]-1H-pyrazolo[3,4-d]pyrimidin-4-one
MOLECULAR FORMULA: C11H9FN6O
MOLECULAR WEIGHT: 260.227163
SMILES: C1=CC(=CC=C1NC2=NC3=C(C=NN3)C(=O)N2N)F
Structure:

CAS RN: 141300-22-3
CAS Name: 5-amino-6-(2-chloroanilino)-1H-pyrazolo[3,4-d]pyrimidin-4-one
OPENEYE Name: 5-amino-6-(2-chloroanilino)-1H-pyrazolo[3,4-d]pyrimidin-4-one
IUPAC Name: 5-amino-6-(2-chloroanilino)-1H-pyrazolo[3,4-d]pyrimidin-4-one
SYSTEMATIC NAME: 5-azanyl-6-[(2-chlorophenyl)amino]-1H-pyrazolo[3,4-d]pyrimidin-4-one
MOLECULAR FORMULA: C11H9ClN6O
MOLECULAR WEIGHT: 276.68176
SMILES: C1=CC=C(C(=C1)NC2=NC3=C(C=NN3)C(=O)N2N)Cl
Structure:

CAS RN: 141300-21-2
CAS Name: 5-amino-6-(4-chloroanilino)-1H-pyrazolo[3,4-d]pyrimidin-4-one
OPENEYE Name: 5-amino-6-(4-chloroanilino)-1H-pyrazolo[3,4-d]pyrimidin-4-one
IUPAC Name: 5-amino-6-(4-chloroanilino)-1H-pyrazolo[3,4-d]pyrimidin-4-one
SYSTEMATIC NAME: 5-azanyl-6-[(4-chlorophenyl)amino]-1H-pyrazolo[3,4-d]pyrimidin-4-one
MOLECULAR FORMULA: C11H9ClN6O
MOLECULAR WEIGHT: 276.68176
SMILES: C1=CC(=CC=C1NC2=NC3=C(C=NN3)C(=O)N2N)Cl
Structure:

CAS RN: 141300-20-1
CAS Name: 5-amino-6-(4-bromoanilino)-1H-pyrazolo[3,4-d]pyrimidin-4-one
OPENEYE Name: 5-amino-6-(4-bromoanilino)-1H-pyrazolo[3,4-d]pyrimidin-4-one
IUPAC Name: 5-amino-6-(4-bromoanilino)-1H-pyrazolo[3,4-d]pyrimidin-4-one
SYSTEMATIC NAME: 5-azanyl-6-[(4-bromophenyl)amino]-1H-pyrazolo[3,4-d]pyrimidin-4-one
MOLECULAR FORMULA: C11H9BrN6O
MOLECULAR WEIGHT: 321.13276
SMILES: C1=CC(=CC=C1NC2=NC3=C(C=NN3)C(=O)N2N)Br
Structure:

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