(2R)-N-(2-azanyl-2-oxidanylidene-ethyl)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide

Systemtic Name: (2R)-N-(2-azanyl-2-oxidanylidene-ethyl)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide Openeye Name: (2R)-N-(2-amino-2-oxo-ethyl)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide CAS Name: (2R)-N-(2-amino-2-oxoethyl)-4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]butanamide IUPAC Name: (2R)-N-(2-amino-2-oxoethyl)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide Traditional Name: (2R)-N-(2-amino-2-keto-ethyl)-4-(methylthio)-2-[(2-phenoxyacetyl)amino]butyramide Formula: C15H21N3O4S MolecularWeight: 339.40994

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC(=O)N)NC(=O)COC1=CC=CC=C1

Isomeric SMILES

CSCC[C@H](C(=O)NCC(=O)N)NC(=O)COC1=CC=CC=C1

InChI

InChI=1S/C15H21N3O4S/c1-23-8-7-12(15(21)17-9-13(16)19)18-14(20)10-22-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3,(H2,16,19)(H,17,21)(H,18,20)/t12-/m1/s1