1-[2-[(4-chlorophenyl)methylsulfanyl]ethanoyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-[(4-chlorophenyl)methylsulfanyl]ethanoyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide Openeye Name: 1-[2-[(4-chlorophenyl)methylsulfanyl]acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide CAS Name: 1-[2-[(4-chlorophenyl)methylthio]-1-oxoethyl]-N-(2-methoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-[(4-chlorophenyl)methylsulfanyl]acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-[2-[(4-chlorobenzyl)thio]acetyl]-N-(2-methoxyphenyl)isonipecotamide Formula: C22H25ClN2O3S MolecularWeight: 432.9635

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2CCN(CC2)C(=O)CSCC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2CCN(CC2)C(=O)CSCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H25ClN2O3S/c1-28-20-5-3-2-4-19(20)24-22(27)17-10-12-25(13-11-17)21(26)15-29-14-16-6-8-18(23)9-7-16/h2-9,17H,10-15H2,1H3,(H,24,27)