N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]azepane-1-sulfonamide

Systemtic Name: N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]azepane-1-sulfonamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]azepane-1-sulfonamide CAS Name: N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-1-azepanesulfonamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]azepane-1-sulfonamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]azepane-1-sulfonamide Formula: C20H34N4O2S MolecularWeight: 394.57456

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H34N4O2S/c25-27(26,24-13-6-1-2-7-14-24)21-11-8-12-22-15-17-23(18-16-22)19-20-9-4-3-5-10-20/h3-5,9-10,21H,1-2,6-8,11-19H2