2,5-dimethyl-N-[3-(1-pyridin-4-ylethylsulfanyl)phenyl]pyrrolidine-1-carboxamide

Systemtic Name: 2,5-dimethyl-N-[3-(1-pyridin-4-ylethylsulfanyl)phenyl]pyrrolidine-1-carboxamide Openeye Name: 2,5-dimethyl-N-[3-[1-(4-pyridyl)ethylsulfanyl]phenyl]pyrrolidine-1-carboxamide CAS Name: 2,5-dimethyl-N-[3-(1-pyridin-4-ylethylthio)phenyl]-1-pyrrolidinecarboxamide IUPAC Name: 2,5-dimethyl-N-[3-(1-pyridin-4-ylethylsulfanyl)phenyl]pyrrolidine-1-carboxamide Traditional Name: 2,5-dimethyl-N-[3-[1-(4-pyridyl)ethylthio]phenyl]pyrrolidine-1-carboxamide Formula: C20H25N3OS MolecularWeight: 355.497

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(N1C(=O)NC2=CC(=CC=C2)SC(C)C3=CC=NC=C3)C

Isomeric SMILES

CC1CCC(N1C(=O)NC2=CC(=CC=C2)SC(C)C3=CC=NC=C3)C

InChI

InChI=1S/C20H25N3OS/c1-14-7-8-15(2)23(14)20(24)22-18-5-4-6-19(13-18)25-16(3)17-9-11-21-12-10-17/h4-6,9-16H,7-8H2,1-3H3,(H,22,24)