Thursday, September 27, 2012

http://ChemLookup.com Compounds




CAS RN: 14585-67-2
CAS Name: N,N-diethyl-2-(3H-inden-1-yl)ethanamine
OPENEYE Name: N,N-diethyl-2-(3H-inden-1-yl)ethanamine
IUPAC Name: N,N-diethyl-2-(3H-inden-1-yl)ethanamine
SYSTEMATIC NAME: N,N-diethyl-2-(3H-inden-1-yl)ethanamine
MOLECULAR FORMULA: C15H21N
MOLECULAR WEIGHT: 215.33394
SMILES: CCN(CC)CCC1=CCC2=CC=CC=C21
Structure:

CAS RN: 14572-50-0
CAS Name: N-methylcarbamic acid (3,4,6-trichloro-2-nitrophenyl) ester
OPENEYE Name: (3,4,6-trichloro-2-nitro-phenyl) N-methylcarbamate
IUPAC Name: (3,4,6-trichloro-2-nitrophenyl) N-methylcarbamate
SYSTEMATIC NAME: [3,4,6-tris(chloranyl)-2-nitro-phenyl] N-methylcarbamate
MOLECULAR FORMULA: C8H5Cl3N2O4
MOLECULAR WEIGHT: 299.4953
SMILES: CNC(=O)OC1=C(C(=C(C=C1Cl)Cl)Cl)[N+](=O)[O-]
Structure:

CAS RN: 14569-74-5
CAS Name: 2-(4-chloro-2-methylphenoxy)acetic acid 4-[2-(4-chloro-2-methylphenoxy)-1-oxoethoxy]but-2-ynyl ester
OPENEYE Name: 4-[2-(4-chloro-2-methyl-phenoxy)acetyl]oxybut-2-ynyl 2-(4-chloro-2-methyl-phenoxy)acetate
IUPAC Name: 4-[2-(4-chloro-2-methylphenoxy)acetyl]oxybut-2-ynyl 2-(4-chloro-2-methylphenoxy)acetate
SYSTEMATIC NAME: 4-[2-(4-chloranyl-2-methyl-phenoxy)ethanoyloxy]but-2-ynyl 2-(4-chloranyl-2-methyl-phenoxy)ethanoate
MOLECULAR FORMULA: C22H20Cl2O6
MOLECULAR WEIGHT: 451.2966
SMILES: CC1=C(C=CC(=C1)Cl)OCC(=O)OCC#CCOC(=O)COC2=C(C=C(C=C2)Cl)C
Structure:

CAS RN: 14563-52-1
CAS Name: N-methyl-4,4-diphenyl-1-cyclohexanamine hydrochloride
OPENEYE Name: N-methyl-4,4-diphenyl-cyclohexanamine hydrochloride
IUPAC Name: N-methyl-4,4-diphenylcyclohexan-1-amine hydrochloride
SYSTEMATIC NAME: N-methyl-4,4-diphenyl-cyclohexan-1-amine hydrochloride
MOLECULAR FORMULA: C19H24ClN
MOLECULAR WEIGHT: 301.85356
SMILES: CNC1CCC(CC1)(C2=CC=CC=C2)C3=CC=CC=C3.Cl
Structure:

CAS RN: 14556-93-5
CAS Name: thiocyanic acid [4-[(2-iodo-1-oxoethyl)amino]-2,5-dimethoxyphenyl] ester
OPENEYE Name: [4-[(2-iodoacetyl)amino]-2,5-dimethoxy-phenyl] thiocyanate
IUPAC Name: [4-[(2-iodoacetyl)amino]-2,5-dimethoxyphenyl] thiocyanate
SYSTEMATIC NAME: [4-(2-iodanylethanoylamino)-2,5-dimethoxy-phenyl] thiocyanate
MOLECULAR FORMULA: C11H11IN2O3S
MOLECULAR WEIGHT: 378.18611
SMILES: COC1=CC(=C(C=C1NC(=O)CI)OC)SC#N
Structure:

CAS RN: 14556-88-8
CAS Name: thiocyanic acid [2,5-dibromo-4-[(2-iodo-1-oxoethyl)amino]phenyl] ester
OPENEYE Name: [2,5-dibromo-4-[(2-iodoacetyl)amino]phenyl] thiocyanate
IUPAC Name: [2,5-dibromo-4-[(2-iodoacetyl)amino]phenyl] thiocyanate
SYSTEMATIC NAME: [2,5-bis(bromanyl)-4-(2-iodanylethanoylamino)phenyl] thiocyanate
MOLECULAR FORMULA: C9H5Br2IN2OS
MOLECULAR WEIGHT: 475.92627
SMILES: C1=C(C(=CC(=C1Br)SC#N)Br)NC(=O)CI
Structure:

CAS RN: 14556-84-4
CAS Name: thiocyanic acid [4-[(2-bromo-1-oxoethyl)amino]-2,5-dichlorophenyl] ester
OPENEYE Name: [4-[(2-bromoacetyl)amino]-2,5-dichloro-phenyl] thiocyanate
IUPAC Name: [4-[(2-bromoacetyl)amino]-2,5-dichlorophenyl] thiocyanate
SYSTEMATIC NAME: [4-(2-bromanylethanoylamino)-2,5-bis(chloranyl)phenyl] thiocyanate
MOLECULAR FORMULA: C9H5BrCl2N2OS
MOLECULAR WEIGHT: 340.0238
SMILES: C1=C(C(=CC(=C1Cl)SC#N)Cl)NC(=O)CBr
Structure:

CAS RN: 14556-83-3
CAS Name: thiocyanic acid [2,5-dichloro-4-[(2-fluoro-1-oxoethyl)amino]phenyl] ester
OPENEYE Name: [2,5-dichloro-4-[(2-fluoroacetyl)amino]phenyl] thiocyanate
IUPAC Name: [2,5-dichloro-4-[(2-fluoroacetyl)amino]phenyl] thiocyanate
SYSTEMATIC NAME: [2,5-bis(chloranyl)-4-(2-fluoranylethanoylamino)phenyl] thiocyanate
MOLECULAR FORMULA: C9H5Cl2FN2OS
MOLECULAR WEIGHT: 279.118203
SMILES: C1=C(C(=CC(=C1Cl)SC#N)Cl)NC(=O)CF
Structure:

CAS RN: 14549-74-7
CAS Name: 1-(4-methylphenyl)-4-pyridin-4-ylpiperazine
OPENEYE Name: 1-(p-tolyl)-4-(4-pyridyl)piperazine
IUPAC Name: 1-(4-methylphenyl)-4-pyridin-4-ylpiperazine
SYSTEMATIC NAME: 1-(4-methylphenyl)-4-pyridin-4-yl-piperazine
MOLECULAR FORMULA: C16H19N3
MOLECULAR WEIGHT: 253.34216
SMILES: CC1=CC=C(C=C1)N2CCN(CC2)C3=CC=NC=C3
Structure:

CAS RN: 14549-73-6
CAS Name: 4-[4-(4-methylphenyl)-1-piperazinyl]pyridine-3,5-diamine
OPENEYE Name: 4-[4-(p-tolyl)piperazin-1-yl]pyridine-3,5-diamine
IUPAC Name: 4-[4-(4-methylphenyl)piperazin-1-yl]pyridine-3,5-diamine
SYSTEMATIC NAME: 4-[4-(4-methylphenyl)piperazin-1-yl]pyridine-3,5-diamine
MOLECULAR FORMULA: C16H21N5
MOLECULAR WEIGHT: 283.37144
SMILES: CC1=CC=C(C=C1)N2CCN(CC2)C3=C(C=NC=C3N)N
Structure:

CAS RN: 14549-71-4
CAS Name: 4-[4-(4-methylphenyl)-1-piperazinyl]-3-pyridinamine
OPENEYE Name: 4-[4-(p-tolyl)piperazin-1-yl]pyridin-3-amine
IUPAC Name: 4-[4-(4-methylphenyl)piperazin-1-yl]pyridin-3-amine
SYSTEMATIC NAME: 4-[4-(4-methylphenyl)piperazin-1-yl]pyridin-3-amine
MOLECULAR FORMULA: C16H20N4
MOLECULAR WEIGHT: 268.3568
SMILES: CC1=CC=C(C=C1)N2CCN(CC2)C3=C(C=NC=C3)N
Structure:

CAS RN: 14549-69-0
CAS Name: 4-[4-(4-chlorophenyl)-1-piperazinyl]-3-pyridinamine
OPENEYE Name: 4-[4-(4-chlorophenyl)piperazin-1-yl]pyridin-3-amine
IUPAC Name: 4-[4-(4-chlorophenyl)piperazin-1-yl]pyridin-3-amine
SYSTEMATIC NAME: 4-[4-(4-chlorophenyl)piperazin-1-yl]pyridin-3-amine
MOLECULAR FORMULA: C15H17ClN4
MOLECULAR WEIGHT: 288.77528
SMILES: C1CN(CCN1C2=CC=C(C=C2)Cl)C3=C(C=NC=C3)N
Structure:

CAS RN: 14549-68-9
CAS Name: 4-[4-(3,4-dimethoxyphenyl)-1-piperazinyl]-3-pyridinamine
OPENEYE Name: 4-[4-(3,4-dimethoxyphenyl)piperazin-1-yl]pyridin-3-amine
IUPAC Name: 4-[4-(3,4-dimethoxyphenyl)piperazin-1-yl]pyridin-3-amine
SYSTEMATIC NAME: 4-[4-(3,4-dimethoxyphenyl)piperazin-1-yl]pyridin-3-amine
MOLECULAR FORMULA: C17H22N4O2
MOLECULAR WEIGHT: 314.38218
SMILES: COC1=C(C=C(C=C1)N2CCN(CC2)C3=C(C=NC=C3)N)OC
Structure:

CAS RN: 14549-67-8
CAS Name: 4-[4-(2,4-dimethoxyphenyl)-1-piperazinyl]-3-pyridinamine
OPENEYE Name: 4-[4-(2,4-dimethoxyphenyl)piperazin-1-yl]pyridin-3-amine
IUPAC Name: 4-[4-(2,4-dimethoxyphenyl)piperazin-1-yl]pyridin-3-amine
SYSTEMATIC NAME: 4-[4-(2,4-dimethoxyphenyl)piperazin-1-yl]pyridin-3-amine
MOLECULAR FORMULA: C17H22N4O2
MOLECULAR WEIGHT: 314.38218
SMILES: COC1=CC(=C(C=C1)N2CCN(CC2)C3=C(C=NC=C3)N)OC
Structure:

CAS RN: 14549-66-7
CAS Name: 4-[4-(4-methoxyphenyl)-1-piperazinyl]-3-pyridinamine
OPENEYE Name: 4-[4-(4-methoxyphenyl)piperazin-1-yl]pyridin-3-amine
IUPAC Name: 4-[4-(4-methoxyphenyl)piperazin-1-yl]pyridin-3-amine
SYSTEMATIC NAME: 4-[4-(4-methoxyphenyl)piperazin-1-yl]pyridin-3-amine
MOLECULAR FORMULA: C16H20N4O
MOLECULAR WEIGHT: 284.3562
SMILES: COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C=NC=C3)N
Structure:

CAS RN: 14549-65-6
CAS Name: 4-[4-(2-methoxyphenyl)-1-piperazinyl]-3-pyridinamine
OPENEYE Name: 4-[4-(2-methoxyphenyl)piperazin-1-yl]pyridin-3-amine
IUPAC Name: 4-[4-(2-methoxyphenyl)piperazin-1-yl]pyridin-3-amine
SYSTEMATIC NAME: 4-[4-(2-methoxyphenyl)piperazin-1-yl]pyridin-3-amine
MOLECULAR FORMULA: C16H20N4O
MOLECULAR WEIGHT: 284.3562
SMILES: COC1=CC=CC=C1N2CCN(CC2)C3=C(C=NC=C3)N
Structure:

CAS RN: 14549-64-5
CAS Name: 2-(4-phenyl-1-piperazinyl)-3-pyridinamine
OPENEYE Name: 2-(4-phenylpiperazin-1-yl)pyridin-3-amine
IUPAC Name: 2-(4-phenylpiperazin-1-yl)pyridin-3-amine
SYSTEMATIC NAME: 2-(4-phenylpiperazin-1-yl)pyridin-3-amine
MOLECULAR FORMULA: C15H18N4
MOLECULAR WEIGHT: 254.33022
SMILES: C1CN(CCN1C2=CC=CC=C2)C3=C(C=CC=N3)N
Structure:

CAS RN: 14549-63-4
CAS Name: 3-(4-phenyl-1-piperazinyl)-4-pyridinamine
OPENEYE Name: 3-(4-phenylpiperazin-1-yl)pyridin-4-amine
IUPAC Name: 3-(4-phenylpiperazin-1-yl)pyridin-4-amine
SYSTEMATIC NAME: 3-(4-phenylpiperazin-1-yl)pyridin-4-amine
MOLECULAR FORMULA: C15H18N4
MOLECULAR WEIGHT: 254.33022
SMILES: C1CN(CCN1C2=CC=CC=C2)C3=C(C=CN=C3)N
Structure:

CAS RN: 14549-62-3
CAS Name: 5-bromo-4-(4-phenyl-1-piperazinyl)-3-pyridinamine
OPENEYE Name: 5-bromo-4-(4-phenylpiperazin-1-yl)pyridin-3-amine
IUPAC Name: 5-bromo-4-(4-phenylpiperazin-1-yl)pyridin-3-amine
SYSTEMATIC NAME: 5-bromanyl-4-(4-phenylpiperazin-1-yl)pyridin-3-amine
MOLECULAR FORMULA: C15H17BrN4
MOLECULAR WEIGHT: 333.22628
SMILES: C1CN(CCN1C2=CC=CC=C2)C3=C(C=NC=C3N)Br
Structure:

CAS RN: 14549-61-2
CAS Name: 1-phenyl-4-pyridin-4-ylpiperazine
OPENEYE Name: 1-phenyl-4-(4-pyridyl)piperazine
IUPAC Name: 1-phenyl-4-pyridin-4-ylpiperazine
SYSTEMATIC NAME: 1-phenyl-4-pyridin-4-yl-piperazine
MOLECULAR FORMULA: C15H17N3
MOLECULAR WEIGHT: 239.31558
SMILES: C1CN(CCN1C2=CC=CC=C2)C3=CC=NC=C3
Structure:

CAS RN: 14549-60-1
CAS Name: 4-[4-(phenylmethyl)-1-piperazinyl]-3-pyridinamine
OPENEYE Name: 4-(4-benzylpiperazin-1-yl)pyridin-3-amine
IUPAC Name: 4-(4-benzylpiperazin-1-yl)pyridin-3-amine
SYSTEMATIC NAME: 4-[4-(phenylmethyl)piperazin-1-yl]pyridin-3-amine
MOLECULAR FORMULA: C16H20N4
MOLECULAR WEIGHT: 268.3568
SMILES: C1CN(CCN1CC2=CC=CC=C2)C3=C(C=NC=C3)N
Structure:

CAS RN: 14549-59-8
CAS Name: 4-(4-methyl-1-piperazinyl)-3-pyridinamine
OPENEYE Name: 4-(4-methylpiperazin-1-yl)pyridin-3-amine
IUPAC Name: 4-(4-methylpiperazin-1-yl)pyridin-3-amine
SYSTEMATIC NAME: 4-(4-methylpiperazin-1-yl)pyridin-3-amine
MOLECULAR FORMULA: C10H16N4
MOLECULAR WEIGHT: 192.26084
SMILES: CN1CCN(CC1)C2=C(C=NC=C2)N
Structure:

CAS RN: 14549-58-7
CAS Name: 1-(3-amino-4-pyridinyl)-4-phenyl-4-piperidinol
OPENEYE Name: 1-(3-amino-4-pyridyl)-4-phenyl-piperidin-4-ol
IUPAC Name: 1-(3-aminopyridin-4-yl)-4-phenylpiperidin-4-ol
SYSTEMATIC NAME: 1-(3-azanylpyridin-4-yl)-4-phenyl-piperidin-4-ol
MOLECULAR FORMULA: C16H19N3O
MOLECULAR WEIGHT: 269.34156
SMILES: C1CN(CCC1(C2=CC=CC=C2)O)C3=C(C=NC=C3)N
Structure:

CAS RN: 14549-57-6
CAS Name: 4-(4-phenyl-1-piperidinyl)-3-pyridinamine
OPENEYE Name: 4-(4-phenyl-1-piperidyl)pyridin-3-amine
IUPAC Name: 4-(4-phenylpiperidin-1-yl)pyridin-3-amine
SYSTEMATIC NAME: 4-(4-phenylpiperidin-1-yl)pyridin-3-amine
MOLECULAR FORMULA: C16H19N3
MOLECULAR WEIGHT: 253.34216
SMILES: C1CN(CCC1C2=CC=CC=C2)C3=C(C=NC=C3)N
Structure:

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