N-[2-(4-phenylpiperazin-1-yl)ethyl]-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(4-phenylpiperazin-1-yl)ethyl]-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(4-isopropylphenyl)sulfonyl-N-[2-(4-phenylpiperazin-1-yl)ethyl]piperidine-4-carboxamide CAS Name: N-[2-(4-phenyl-1-piperazinyl)ethyl]-1-(4-propan-2-ylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(4-phenylpiperazin-1-yl)ethyl]-1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-p-cumenylsulfonyl-N-[2-(4-phenylpiperazino)ethyl]isonipecotamide Formula: C27H38N4O3S MolecularWeight: 498.68062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C27H38N4O3S/c1-22(2)23-8-10-26(11-9-23)35(33,34)31-15-12-24(13-16-31)27(32)28-14-17-29-18-20-30(21-19-29)25-6-4-3-5-7-25/h3-11,22,24H,12-21H2,1-2H3,(H,28,32)