[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 2-(1,3-benzoxazol-2-ylsulfanyl)ethanoate

Systemtic Name: [2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 2-(1,3-benzoxazol-2-ylsulfanyl)ethanoate Openeye Name: [2-(2,4-dimethoxyanilino)-2-oxo-ethyl] 2-(1,3-benzoxazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzoxazol-2-ylthio)acetic acid [2-(2,4-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dimethoxyanilino)-2-oxoethyl] 2-(1,3-benzoxazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzoxazol-2-ylthio)acetic acid [2-(2,4-dimethoxyanilino)-2-keto-ethyl] ester Formula: C19H18N2O6S MolecularWeight: 402.42102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)COC(=O)CSC2=NC3=CC=CC=C3O2)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)COC(=O)CSC2=NC3=CC=CC=C3O2)OC

InChI

InChI=1S/C19H18N2O6S/c1-24-12-7-8-14(16(9-12)25-2)20-17(22)10-26-18(23)11-28-19-21-13-5-3-4-6-15(13)27-19/h3-9H,10-11H2,1-2H3,(H,20,22)