1-methylsulfonyl-N-[4-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenyl]piperidine-4-carboxamide

Systemtic Name: 1-methylsulfonyl-N-[4-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenyl]piperidine-4-carboxamide Openeye Name: N-[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: 1-methylsulfonyl-N-[4-[[4-(phenylmethyl)-1-piperazinyl]methyl]phenyl]-4-piperidinecarboxamide IUPAC Name: N-[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-[4-[(4-benzylpiperazino)methyl]phenyl]-1-mesyl-isonipecotamide Formula: C25H34N4O3S MolecularWeight: 470.62746

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)CN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)CN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H34N4O3S/c1-33(31,32)29-13-11-23(12-14-29)25(30)26-24-9-7-22(8-10-24)20-28-17-15-27(16-18-28)19-21-5-3-2-4-6-21/h2-10,23H,11-20H2,1H3,(H,26,30)