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

Systemtic Name: N-[4-(cyanomethyl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Openeye Name: N-[4-(cyanomethyl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide CAS Name: N-[4-(cyanomethyl)phenyl]-1-(3-phenylpropylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Traditional Name: N-[4-(cyanomethyl)phenyl]-1-(3-phenylpropylsulfonyl)isonipecotamide Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)CC#N)S(=O)(=O)CCCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)CC#N)S(=O)(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C23H27N3O3S/c24-15-12-20-8-10-22(11-9-20)25-23(27)21-13-16-26(17-14-21)30(28,29)18-4-7-19-5-2-1-3-6-19/h1-3,5-6,8-11,21H,4,7,12-14,16-18H2,(H,25,27)