(2S)-2-azanyl-N-methyl-4-methylsulfanyl-N-(2-pyridin-4-ylethyl)butanamide

Systemtic Name: (2S)-2-azanyl-N-methyl-4-methylsulfanyl-N-(2-pyridin-4-ylethyl)butanamide Openeye Name: (2S)-2-amino-N-methyl-4-methylsulfanyl-N-[2-(4-pyridyl)ethyl]butanamide CAS Name: (2S)-2-amino-N-methyl-4-(methylthio)-N-(2-pyridin-4-ylethyl)butanamide IUPAC Name: (2S)-2-amino-N-methyl-4-methylsulfanyl-N-(2-pyridin-4-ylethyl)butanamide Traditional Name: (2S)-2-amino-N-methyl-4-(methylthio)-N-[2-(4-pyridyl)ethyl]butyramide Formula: C13H21N3OS MolecularWeight: 267.39034

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=NC=C1)C(=O)C(CCSC)N

Isomeric SMILES

CN(CCC1=CC=NC=C1)C(=O)[C@H](CCSC)N

InChI

InChI=1S/C13H21N3OS/c1-16(13(17)12(14)6-10-18-2)9-5-11-3-7-15-8-4-11/h3-4,7-8,12H,5-6,9-10,14H2,1-2H3/t12-/m0/s1