(3S)-N-[(4-methylsulfanylphenyl)methyl]-6-oxidanylidene-1-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]piperidine-3-carboxamide

Systemtic Name: (3S)-N-[(4-methylsulfanylphenyl)methyl]-6-oxidanylidene-1-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]piperidine-3-carboxamide Openeye Name: (3S)-N-[(4-methylsulfanylphenyl)methyl]-6-oxo-1-[3-(2-oxopyrrolidin-1-yl)propyl]piperidine-3-carboxamide CAS Name: (3S)-N-[[4-(methylthio)phenyl]methyl]-6-oxo-1-[3-(2-oxo-1-pyrrolidinyl)propyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-[(4-methylsulfanylphenyl)methyl]-6-oxo-1-[3-(2-oxopyrrolidin-1-yl)propyl]piperidine-3-carboxamide Traditional Name: (3S)-6-keto-1-[3-(2-ketopyrrolidino)propyl]-N-[4-(methylthio)benzyl]nipecotamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC(=O)C2CCC(=O)N(C2)CCCN3CCCC3=O

Isomeric SMILES

CSC1=CC=C(C=C1)CNC(=O)[C@H]2CCC(=O)N(C2)CCCN3CCCC3=O

InChI

InChI=1S/C21H29N3O3S/c1-28-18-8-5-16(6-9-18)14-22-21(27)17-7-10-20(26)24(15-17)13-3-12-23-11-2-4-19(23)25/h5-6,8-9,17H,2-4,7,10-15H2,1H3,(H,22,27)/t17-/m0/s1