3-azanyl-5-methylsulfanyl-2-oxidanyl-N-(2-pyridin-4-ylethyl)pentanamide

Systemtic Name: 3-azanyl-5-methylsulfanyl-2-oxidanyl-N-(2-pyridin-4-ylethyl)pentanamide Openeye Name: 3-amino-2-hydroxy-5-methylsulfanyl-N-[2-(4-pyridyl)ethyl]pentanamide CAS Name: 3-amino-2-hydroxy-5-(methylthio)-N-(2-pyridin-4-ylethyl)pentanamide IUPAC Name: 3-amino-2-hydroxy-5-methylsulfanyl-N-(2-pyridin-4-ylethyl)pentanamide Traditional Name: 3-amino-2-hydroxy-5-(methylthio)-N-[2-(4-pyridyl)ethyl]valeramide Formula: C13H21N3O2S MolecularWeight: 283.38974

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(C(=O)NCCC1=CC=NC=C1)O)N

Isomeric SMILES

CSCCC(C(C(=O)NCCC1=CC=NC=C1)O)N

InChI

InChI=1S/C13H21N3O2S/c1-19-9-5-11(14)12(17)13(18)16-8-4-10-2-6-15-7-3-10/h2-3,6-7,11-12,17H,4-5,8-9,14H2,1H3,(H,16,18)