3-[methyl(2-pyridin-2-ylethyl)amino]pentanethioamide

Systemtic Name: 3-[methyl(2-pyridin-2-ylethyl)amino]pentanethioamide Openeye Name: 3-[methyl-[2-(2-pyridyl)ethyl]amino]pentanethioamide CAS Name: 3-[methyl-[2-(2-pyridinyl)ethyl]amino]pentanethioamide IUPAC Name: 3-[methyl(2-pyridin-2-ylethyl)amino]pentanethioamide Traditional Name: 3-[methyl-[2-(2-pyridyl)ethyl]amino]thiovaleramide Formula: C13H21N3S MolecularWeight: 251.39094

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=S)N)N(C)CCC1=CC=CC=N1

Isomeric SMILES

CCC(CC(=S)N)N(C)CCC1=CC=CC=N1

InChI

InChI=1S/C13H21N3S/c1-3-12(10-13(14)17)16(2)9-7-11-6-4-5-8-15-11/h4-6,8,12H,3,7,9-10H2,1-2H3,(H2,14,17)