N-[1-[4-(propanoylamino)phenyl]ethyl]-1-propylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[1-[4-(propanoylamino)phenyl]ethyl]-1-propylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[1-[4-(propanoylamino)phenyl]ethyl]-1-propylsulfonyl-piperidine-3-carboxamide CAS Name: N-[1-[4-(1-oxopropylamino)phenyl]ethyl]-1-propylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[1-[4-(propanoylamino)phenyl]ethyl]-1-propylsulfonylpiperidine-3-carboxamide Traditional Name: N-[1-(4-propionamidophenyl)ethyl]-1-propylsulfonyl-nipecotamide Formula: C20H31N3O4S MolecularWeight: 409.54284

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)C(=O)NC(C)C2=CC=C(C=C2)NC(=O)CC

Isomeric SMILES

CCCS(=O)(=O)N1CCCC(C1)C(=O)NC(C)C2=CC=C(C=C2)NC(=O)CC

InChI

InChI=1S/C20H31N3O4S/c1-4-13-28(26,27)23-12-6-7-17(14-23)20(25)21-15(3)16-8-10-18(11-9-16)22-19(24)5-2/h8-11,15,17H,4-7,12-14H2,1-3H3,(H,21,25)(H,22,24)