[1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 2-[(3-methyl-1,2-oxazol-5-yl)methylsulfanyl]benzoate

Systemtic Name: [1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 2-[(3-methyl-1,2-oxazol-5-yl)methylsulfanyl]benzoate Openeye Name: [2-(allylamino)-1-methyl-2-oxo-ethyl] 2-[(3-methylisoxazol-5-yl)methylsulfanyl]benzoate CAS Name: 2-[(3-methyl-5-isoxazolyl)methylthio]benzoic acid [1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(prop-2-enylamino)propan-2-yl] 2-[(3-methyl-1,2-oxazol-5-yl)methylsulfanyl]benzoate Traditional Name: 2-[(3-methylisoxazol-5-yl)methylthio]benzoic acid [2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CSC2=CC=CC=C2C(=O)OC(C)C(=O)NCC=C

Isomeric SMILES

CC1=NOC(=C1)CSC2=CC=CC=C2C(=O)OC(C)C(=O)NCC=C

InChI

InChI=1S/C18H20N2O4S/c1-4-9-19-17(21)13(3)23-18(22)15-7-5-6-8-16(15)25-11-14-10-12(2)20-24-14/h4-8,10,13H,1,9,11H2,2-3H3,(H,19,21)