4-(4-ethoxyphenyl)carbonyl-N-(4-methylsulfanylphenyl)piperidine-1-carboxamide

Systemtic Name: 4-(4-ethoxyphenyl)carbonyl-N-(4-methylsulfanylphenyl)piperidine-1-carboxamide Openeye Name: 4-(4-ethoxybenzoyl)-N-(4-methylsulfanylphenyl)piperidine-1-carboxamide CAS Name: 4-[(4-ethoxyphenyl)-oxomethyl]-N-[4-(methylthio)phenyl]-1-piperidinecarboxamide IUPAC Name: 4-(4-ethoxybenzoyl)-N-(4-methylsulfanylphenyl)piperidine-1-carboxamide Traditional Name: 4-(4-ethoxybenzoyl)-N-[4-(methylthio)phenyl]piperidine-1-carboxamide Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=O)NC3=CC=C(C=C3)SC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=O)NC3=CC=C(C=C3)SC

InChI

InChI=1S/C22H26N2O3S/c1-3-27-19-8-4-16(5-9-19)21(25)17-12-14-24(15-13-17)22(26)23-18-6-10-20(28-2)11-7-18/h4-11,17H,3,12-15H2,1-2H3,(H,23,26)