(2S)-2-acetamido-N-(2-azanyl-2-oxidanylidene-ethyl)-3-phenylsulfanyl-propanamide

Systemtic Name: (2S)-2-acetamido-N-(2-azanyl-2-oxidanylidene-ethyl)-3-phenylsulfanyl-propanamide Openeye Name: (2S)-2-acetamido-N-(2-amino-2-oxo-ethyl)-3-phenylsulfanyl-propanamide CAS Name: (2S)-2-acetamido-N-(2-amino-2-oxoethyl)-3-(phenylthio)propanamide IUPAC Name: (2S)-2-acetamido-N-(2-amino-2-oxoethyl)-3-phenylsulfanylpropanamide Traditional Name: (2S)-2-acetamido-N-(2-amino-2-keto-ethyl)-3-(phenylthio)propionamide Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC1=CC=CC=C1)C(=O)NCC(=O)N

Isomeric SMILES

CC(=O)N[C@H](CSC1=CC=CC=C1)C(=O)NCC(=O)N

InChI

InChI=1S/C13H17N3O3S/c1-9(17)16-11(13(19)15-7-12(14)18)8-20-10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3,(H2,14,18)(H,15,19)(H,16,17)/t11-/m1/s1