1-(3-phenylpropylsulfonyl)-N-[(4-piperidin-1-ylphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-(3-phenylpropylsulfonyl)-N-[(4-piperidin-1-ylphenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-(3-phenylpropylsulfonyl)-N-[[4-(1-piperidyl)phenyl]methyl]piperidine-3-carboxamide CAS Name: 1-(3-phenylpropylsulfonyl)-N-[[4-(1-piperidinyl)phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: 1-(3-phenylpropylsulfonyl)-N-[(4-piperidin-1-ylphenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-(3-phenylpropylsulfonyl)-N-(4-piperidinobenzyl)nipecotamide Formula: C27H37N3O3S MolecularWeight: 483.66598

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)CNC(=O)C3CCCN(C3)S(=O)(=O)CCCC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)CNC(=O)C3CCCN(C3)S(=O)(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C27H37N3O3S/c31-27(28-21-24-13-15-26(16-14-24)29-17-5-2-6-18-29)25-12-7-19-30(22-25)34(32,33)20-8-11-23-9-3-1-4-10-23/h1,3-4,9-10,13-16,25H,2,5-8,11-12,17-22H2,(H,28,31)