N-(2-phenylsulfanylethyl)-1-propylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(2-phenylsulfanylethyl)-1-propylsulfonyl-piperidine-3-carboxamide Openeye Name: N-(2-phenylsulfanylethyl)-1-propylsulfonyl-piperidine-3-carboxamide CAS Name: N-[2-(phenylthio)ethyl]-1-propylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-(2-phenylsulfanylethyl)-1-propylsulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(phenylthio)ethyl]-1-propylsulfonyl-nipecotamide Formula: C17H26N2O3S2 MolecularWeight: 370.52994

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)C(=O)NCCSC2=CC=CC=C2

Isomeric SMILES

CCCS(=O)(=O)N1CCCC(C1)C(=O)NCCSC2=CC=CC=C2

InChI

InChI=1S/C17H26N2O3S2/c1-2-13-24(21,22)19-11-6-7-15(14-19)17(20)18-10-12-23-16-8-4-3-5-9-16/h3-5,8-9,15H,2,6-7,10-14H2,1H3,(H,18,20)