(phenylmethyl) 2-[(2S)-1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoate

Systemtic Name: (phenylmethyl) 2-[(2S)-1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoate Openeye Name: benzyl 2-[(1S)-1-methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[(2S)-1-[(5-methyl-3-isoxazolyl)amino]-1-oxopropan-2-yl]thio]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(2S)-1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]sulfanylacetate Traditional Name: 2-[[(1S)-2-keto-1-methyl-2-[(5-methylisoxazol-3-yl)amino]ethyl]thio]acetic acid benzyl ester Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=NO1)NC(=O)[C@H](C)SCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H18N2O4S/c1-11-8-14(18-22-11)17-16(20)12(2)23-10-15(19)21-9-13-6-4-3-5-7-13/h3-8,12H,9-10H2,1-2H3,(H,17,18,20)/t12-/m0/s1