methyl 4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanylmethyl]benzoate

Systemtic Name: methyl 4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanylmethyl]benzoate Openeye Name: methyl 4-[[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]sulfanylmethyl]benzoate CAS Name: 4-[[[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]sulfanylmethyl]benzoate Traditional Name: 4-[[[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]thio]methyl]benzoic acid methyl ester Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CSCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CSCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C15H16N2O4S/c1-10-7-13(17-21-10)16-14(18)9-22-8-11-3-5-12(6-4-11)15(19)20-2/h3-7H,8-9H2,1-2H3,(H,16,17,18)