(2-benzamido-2-oxidanylidene-ethyl) 2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) 2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: (2-benzamido-2-oxo-ethyl) 2-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]thio]acetic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) 2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]thio]acetic acid (2-benzamido-2-keto-ethyl) ester Formula: C17H17N3O6S MolecularWeight: 391.39838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CSCC(=O)OCC(=O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CSCC(=O)OCC(=O)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H17N3O6S/c1-11-7-13(20-26-11)18-15(22)9-27-10-16(23)25-8-14(21)19-17(24)12-5-3-2-4-6-12/h2-7H,8-10H2,1H3,(H,18,20,22)(H,19,21,24)