[2-[(3-chlorophenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl 3,4-dimethylbenzoate

Systemtic Name: [2-[(3-chlorophenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl 3,4-dimethylbenzoate Openeye Name: [2-(N-acetyl-3-chloro-anilino)thiazol-4-yl]methyl 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid [2-(N-acetyl-3-chloroanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-3-chloroanilino)-1,3-thiazol-4-yl]methyl 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid [2-(N-acetyl-3-chloro-anilino)thiazol-4-yl]methyl ester Formula: C21H19ClN2O3S MolecularWeight: 414.90516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=CSC(=N2)N(C3=CC(=CC=C3)Cl)C(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=CSC(=N2)N(C3=CC(=CC=C3)Cl)C(=O)C)C

InChI

InChI=1S/C21H19ClN2O3S/c1-13-7-8-16(9-14(13)2)20(26)27-11-18-12-28-21(23-18)24(15(3)25)19-6-4-5-17(22)10-19/h4-10,12H,11H2,1-3H3