N-[(4-methylphenyl)-phenyl-methyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[(4-methylphenyl)-phenyl-methyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(3-phenylpropylsulfonyl)-N-[phenyl(p-tolyl)methyl]piperidine-4-carboxamide CAS Name: N-[(4-methylphenyl)-phenylmethyl]-1-(3-phenylpropylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[(4-methylphenyl)-phenylmethyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Traditional Name: 1-(3-phenylpropylsulfonyl)-N-[phenyl(p-tolyl)methyl]isonipecotamide Formula: C29H34N2O3S MolecularWeight: 490.65686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)CCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C29H34N2O3S/c1-23-14-16-26(17-15-23)28(25-12-6-3-7-13-25)30-29(32)27-18-20-31(21-19-27)35(33,34)22-8-11-24-9-4-2-5-10-24/h2-7,9-10,12-17,27-28H,8,11,18-22H2,1H3,(H,30,32)