(2R)-1-[(3S)-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperidine-2-carboxamide

Systemtic Name: (2R)-1-[(3S)-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperidine-2-carboxamide Openeye Name: (2R)-1-[(3S)-1-(3-methylsulfanylphenyl)-5-oxo-pyrrolidine-3-carbonyl]piperidine-2-carboxamide CAS Name: (2R)-1-[[(3S)-1-[3-(methylthio)phenyl]-5-oxo-3-pyrrolidinyl]-oxomethyl]-2-piperidinecarboxamide IUPAC Name: (2R)-1-[(3S)-1-(3-methylsulfanylphenyl)-5-oxopyrrolidine-3-carbonyl]piperidine-2-carboxamide Traditional Name: (2R)-1-[(3S)-5-keto-1-[3-(methylthio)phenyl]pyrrolidine-3-carbonyl]pipecolinamide Formula: C18H23N3O3S MolecularWeight: 361.45852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)N2CC(CC2=O)C(=O)N3CCCCC3C(=O)N

Isomeric SMILES

CSC1=CC=CC(=C1)N2C[C@H](CC2=O)C(=O)N3CCCC[C@@H]3C(=O)N

InChI

InChI=1S/C18H23N3O3S/c1-25-14-6-4-5-13(10-14)21-11-12(9-16(21)22)18(24)20-8-3-2-7-15(20)17(19)23/h4-6,10,12,15H,2-3,7-9,11H2,1H3,(H2,19,23)/t12-,15+/m0/s1