1-methylsulfonyl-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]piperidine-3-carboxamide

Systemtic Name: 1-methylsulfonyl-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]piperidine-3-carboxamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: 1-methylsulfonyl-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-3-piperidinecarboxamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]-1-mesyl-nipecotamide Formula: C21H34N4O3S MolecularWeight: 422.58466

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC(C1)C(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)N1CCCC(C1)C(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H34N4O3S/c1-29(27,28)25-12-5-9-20(18-25)21(26)22-10-6-11-23-13-15-24(16-14-23)17-19-7-3-2-4-8-19/h2-4,7-8,20H,5-6,9-18H2,1H3,(H,22,26)