N-methyl-3-[3-[4-(phenylmethyl)piperazin-1-yl]propanoyl]benzenesulfonamide dihydrochloride

Systemtic Name: N-methyl-3-[3-[4-(phenylmethyl)piperazin-1-yl]propanoyl]benzenesulfonamide dihydrochloride Openeye Name: 3-[3-(4-benzylpiperazin-1-yl)propanoyl]-N-methyl-benzenesulfonamide dihydrochloride CAS Name: N-methyl-3-[1-oxo-3-[4-(phenylmethyl)-1-piperazinyl]propyl]benzenesulfonamide dihydrochloride IUPAC Name: 3-[3-(4-benzylpiperazin-1-yl)propanoyl]-N-methylbenzenesulfonamide dihydrochloride Traditional Name: 3-[3-(4-benzylpiperazino)propanoyl]-N-methyl-benzenesulfonamide dihydrochloride Formula: C21H29Cl2N3O3S MolecularWeight: 474.44426

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=CC(=C1)C(=O)CCN2CCN(CC2)CC3=CC=CC=C3.Cl.Cl

Isomeric SMILES

CNS(=O)(=O)C1=CC=CC(=C1)C(=O)CCN2CCN(CC2)CC3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C21H27N3O3S.2ClH/c1-22-28(26,27)20-9-5-8-19(16-20)21(25)10-11-23-12-14-24(15-13-23)17-18-6-3-2-4-7-18;;/h2-9,16,22H,10-15,17H2,1H3;2*1H