N-[(4-methylsulfanylphenyl)methyl]-1-(2-morpholin-4-ylethyl)-6-oxidanylidene-piperidine-3-carboxamide

Systemtic Name: N-[(4-methylsulfanylphenyl)methyl]-1-(2-morpholin-4-ylethyl)-6-oxidanylidene-piperidine-3-carboxamide Openeye Name: N-[(4-methylsulfanylphenyl)methyl]-1-(2-morpholinoethyl)-6-oxo-piperidine-3-carboxamide CAS Name: N-[[4-(methylthio)phenyl]methyl]-1-[2-(4-morpholinyl)ethyl]-6-oxo-3-piperidinecarboxamide IUPAC Name: N-[(4-methylsulfanylphenyl)methyl]-1-(2-morpholin-4-ylethyl)-6-oxopiperidine-3-carboxamide Traditional Name: 6-keto-N-[4-(methylthio)benzyl]-1-(2-morpholinoethyl)nipecotamide Formula: C20H29N3O3S MolecularWeight: 391.52756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC(=O)C2CCC(=O)N(C2)CCN3CCOCC3

Isomeric SMILES

CSC1=CC=C(C=C1)CNC(=O)C2CCC(=O)N(C2)CCN3CCOCC3

InChI

InChI=1S/C20H29N3O3S/c1-27-18-5-2-16(3-6-18)14-21-20(25)17-4-7-19(24)23(15-17)9-8-22-10-12-26-13-11-22/h2-3,5-6,17H,4,7-15H2,1H3,(H,21,25)