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

Systemtic Name: [2-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methyl 4-butoxybenzoate Openeye Name: [2-[2-(2-methylanilino)-2-oxo-ethyl]thiazol-4-yl]methyl 4-butoxybenzoate CAS Name: 4-butoxybenzoic 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-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2-[2-keto-2-(o-toluidino)ethyl]thiazol-4-yl]methyl ester Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OCC2=CSC(=N2)CC(=O)NC3=CC=CC=C3C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OCC2=CSC(=N2)CC(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C24H26N2O4S/c1-3-4-13-29-20-11-9-18(10-12-20)24(28)30-15-19-16-31-23(25-19)14-22(27)26-21-8-6-5-7-17(21)2/h5-12,16H,3-4,13-15H2,1-2H3,(H,26,27)