4-[methyl(2-pyridin-2-ylethyl)amino]butanethioamide

Systemtic Name: 4-[methyl(2-pyridin-2-ylethyl)amino]butanethioamide Openeye Name: 4-[methyl-[2-(2-pyridyl)ethyl]amino]butanethioamide CAS Name: 4-[methyl-[2-(2-pyridinyl)ethyl]amino]butanethioamide IUPAC Name: 4-[methyl(2-pyridin-2-ylethyl)amino]butanethioamide Traditional Name: 4-[methyl-[2-(2-pyridyl)ethyl]amino]thiobutyramide Formula: C12H19N3S MolecularWeight: 237.36436

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=S)N)CCC1=CC=CC=N1

Isomeric SMILES

CN(CCCC(=S)N)CCC1=CC=CC=N1

InChI

InChI=1S/C12H19N3S/c1-15(9-4-6-12(13)16)10-7-11-5-2-3-8-14-11/h2-3,5,8H,4,6-7,9-10H2,1H3,(H2,13,16)