(2S)-2-acetamido-N-(2-azanyl-2-oxidanylidene-ethyl)-3-(4-methylphenyl)sulfanyl-propanamide

Systemtic Name: (2S)-2-acetamido-N-(2-azanyl-2-oxidanylidene-ethyl)-3-(4-methylphenyl)sulfanyl-propanamide Openeye Name: (2S)-2-acetamido-N-(2-amino-2-oxo-ethyl)-3-(p-tolylsulfanyl)propanamide CAS Name: (2S)-2-acetamido-N-(2-amino-2-oxoethyl)-3-[(4-methylphenyl)thio]propanamide IUPAC Name: (2S)-2-acetamido-N-(2-amino-2-oxoethyl)-3-(4-methylphenyl)sulfanylpropanamide Traditional Name: (2S)-2-acetamido-N-(2-amino-2-keto-ethyl)-3-(p-tolylthio)propionamide Formula: C14H19N3O3S MolecularWeight: 309.38396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(C(=O)NCC(=O)N)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SC[C@H](C(=O)NCC(=O)N)NC(=O)C

InChI

InChI=1S/C14H19N3O3S/c1-9-3-5-11(6-4-9)21-8-12(17-10(2)18)14(20)16-7-13(15)19/h3-6,12H,7-8H2,1-2H3,(H2,15,19)(H,16,20)(H,17,18)/t12-/m1/s1