N-methyl-N-[(3-methylsulfanylphenyl)methyl]-6-oxidanylidene-1-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]piperidine-3-carboxamide

Systemtic Name: N-methyl-N-[(3-methylsulfanylphenyl)methyl]-6-oxidanylidene-1-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]piperidine-3-carboxamide Openeye Name: N-methyl-N-[(3-methylsulfanylphenyl)methyl]-6-oxo-1-[3-(2-oxopyrrolidin-1-yl)propyl]piperidine-3-carboxamide CAS Name: N-methyl-N-[[3-(methylthio)phenyl]methyl]-6-oxo-1-[3-(2-oxo-1-pyrrolidinyl)propyl]-3-piperidinecarboxamide IUPAC Name: N-methyl-N-[(3-methylsulfanylphenyl)methyl]-6-oxo-1-[3-(2-oxopyrrolidin-1-yl)propyl]piperidine-3-carboxamide Traditional Name: 6-keto-1-[3-(2-ketopyrrolidino)propyl]-N-methyl-N-[3-(methylthio)benzyl]nipecotamide Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)SC)C(=O)C2CCC(=O)N(C2)CCCN3CCCC3=O

Isomeric SMILES

CN(CC1=CC(=CC=C1)SC)C(=O)C2CCC(=O)N(C2)CCCN3CCCC3=O

InChI

InChI=1S/C22H31N3O3S/c1-23(15-17-6-3-7-19(14-17)29-2)22(28)18-9-10-21(27)25(16-18)13-5-12-24-11-4-8-20(24)26/h3,6-7,14,18H,4-5,8-13,15-16H2,1-2H3