N-[(4-methylsulfonylphenyl)methyl]-4-phenyl-1-(3-phenylpropanoyl)piperidine-4-carboxamide

Systemtic Name: N-[(4-methylsulfonylphenyl)methyl]-4-phenyl-1-(3-phenylpropanoyl)piperidine-4-carboxamide Openeye Name: N-[(4-methylsulfonylphenyl)methyl]-4-phenyl-1-(3-phenylpropanoyl)piperidine-4-carboxamide CAS Name: N-[(4-methylsulfonylphenyl)methyl]-1-(1-oxo-3-phenylpropyl)-4-phenyl-4-piperidinecarboxamide IUPAC Name: N-[(4-methylsulfonylphenyl)methyl]-4-phenyl-1-(3-phenylpropanoyl)piperidine-4-carboxamide Traditional Name: 1-hydrocinnamoyl-N-(4-mesylbenzyl)-4-phenyl-isonipecotamide Formula: C29H32N2O4S MolecularWeight: 504.64038

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2(CCN(CC2)C(=O)CCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2(CCN(CC2)C(=O)CCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H32N2O4S/c1-36(34,35)26-15-12-24(13-16-26)22-30-28(33)29(25-10-6-3-7-11-25)18-20-31(21-19-29)27(32)17-14-23-8-4-2-5-9-23/h2-13,15-16H,14,17-22H2,1H3,(H,30,33)