N-[3-[3-[4-(phenylmethyl)piperazin-1-yl]propanoyl]phenyl]methanesulfonamide

Systemtic Name: N-[3-[3-[4-(phenylmethyl)piperazin-1-yl]propanoyl]phenyl]methanesulfonamide Openeye Name: N-[3-[3-(4-benzylpiperazin-1-yl)propanoyl]phenyl]methanesulfonamide CAS Name: N-[3-[1-oxo-3-[4-(phenylmethyl)-1-piperazinyl]propyl]phenyl]methanesulfonamide IUPAC Name: N-[3-[3-(4-benzylpiperazin-1-yl)propanoyl]phenyl]methanesulfonamide Traditional Name: N-[3-[3-(4-benzylpiperazino)propanoyl]phenyl]methanesulfonamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC(=C1)C(=O)CCN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC(=C1)C(=O)CCN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H27N3O3S/c1-28(26,27)22-20-9-5-8-19(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