[2-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methyl 4-pentoxybenzoate

Systemtic Name: [2-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methyl 4-pentoxybenzoate Openeye Name: [2-[2-(2-methylanilino)-2-oxo-ethyl]thiazol-4-yl]methyl 4-pentoxybenzoate CAS Name: 4-pentoxybenzoic acid [2-[2-(2-methylanilino)-2-oxoethyl]-4-thiazolyl]methyl ester IUPAC Name: [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 4-pentoxybenzoate Traditional Name: 4-amoxybenzoic acid [2-[2-keto-2-(o-toluidino)ethyl]thiazol-4-yl]methyl ester Formula: C25H28N2O4S MolecularWeight: 452.56582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)OCC2=CSC(=N2)CC(=O)NC3=CC=CC=C3C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)OCC2=CSC(=N2)CC(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C25H28N2O4S/c1-3-4-7-14-30-21-12-10-19(11-13-21)25(29)31-16-20-17-32-24(26-20)15-23(28)27-22-9-6-5-8-18(22)2/h5-6,8-13,17H,3-4,7,14-16H2,1-2H3,(H,27,28)