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

Systemtic Name: methyl 4-[[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylmethyl]benzoate Openeye Name: methyl 4-[[1-methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]sulfanylmethyl]benzoate CAS Name: 4-[[[1-[(5-methyl-3-isoxazolyl)amino]-1-oxopropan-2-yl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]sulfanylmethyl]benzoate Traditional Name: 4-[[[2-keto-1-methyl-2-[(5-methylisoxazol-3-yl)amino]ethyl]thio]methyl]benzoic acid methyl ester Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C)SCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C16H18N2O4S/c1-10-8-14(18-22-10)17-15(19)11(2)23-9-12-4-6-13(7-5-12)16(20)21-3/h4-8,11H,9H2,1-3H3,(H,17,18,19)