[2-[[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl] 2-bromanylbenzoate

Systemtic Name: [2-[[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl] 2-bromanylbenzoate Openeye Name: [2-[[4-(3,4-dimethylphenyl)thiazol-2-yl]amino]-2-oxo-ethyl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [2-[[4-(3,4-dimethylphenyl)-2-thiazolyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [2-[[4-(3,4-dimethylphenyl)thiazol-2-yl]amino]-2-keto-ethyl] ester Formula: C20H17BrN2O3S MolecularWeight: 445.32958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)COC(=O)C3=CC=CC=C3Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)COC(=O)C3=CC=CC=C3Br)C

InChI

InChI=1S/C20H17BrN2O3S/c1-12-7-8-14(9-13(12)2)17-11-27-20(22-17)23-18(24)10-26-19(25)15-5-3-4-6-16(15)21/h3-9,11H,10H2,1-2H3,(H,22,23,24)