[2-[ethanoyl-(3-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 4-methyl-2-oxidanyl-benzoate

Systemtic Name: [2-[ethanoyl-(3-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 4-methyl-2-oxidanyl-benzoate Openeye Name: [2-(N-acetyl-3-methyl-anilino)thiazol-4-yl]methyl 2-hydroxy-4-methyl-benzoate CAS Name: 2-hydroxy-4-methylbenzoic acid [2-(N-acetyl-3-methylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-3-methylanilino)-1,3-thiazol-4-yl]methyl 2-hydroxy-4-methylbenzoate Traditional Name: 2-hydroxy-4-methyl-benzoic acid [2-(N-acetyl-3-methyl-anilino)thiazol-4-yl]methyl ester Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(C2=NC(=CS2)COC(=O)C3=C(C=C(C=C3)C)O)C(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N(C2=NC(=CS2)COC(=O)C3=C(C=C(C=C3)C)O)C(=O)C

InChI

InChI=1S/C21H20N2O4S/c1-13-5-4-6-17(9-13)23(15(3)24)21-22-16(12-28-21)11-27-20(26)18-8-7-14(2)10-19(18)25/h4-10,12,25H,11H2,1-3H3