methyl 5-methyl-4-[2-[(4-phenoxyphenyl)amino]-1,3-thiazol-4-yl]thiophene-2-carboxylate hydrobromide

Systemtic Name: methyl 5-methyl-4-[2-[(4-phenoxyphenyl)amino]-1,3-thiazol-4-yl]thiophene-2-carboxylate hydrobromide Openeye Name: methyl 5-methyl-4-[2-(4-phenoxyanilino)thiazol-4-yl]thiophene-2-carboxylate hydrobromide CAS Name: 5-methyl-4-[2-(4-phenoxyanilino)-4-thiazolyl]-2-thiophenecarboxylic acid methyl ester hydrobromide IUPAC Name: methyl 5-methyl-4-[2-(4-phenoxyanilino)-1,3-thiazol-4-yl]thiophene-2-carboxylate hydrobromide Traditional Name: 5-methyl-4-[2-(4-phenoxyanilino)thiazol-4-yl]thiophene-2-carboxylic acid methyl ester hydrobromide Formula: C22H19BrN2O3S2 MolecularWeight: 503.43186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C(=O)OC)C2=CSC(=N2)NC3=CC=C(C=C3)OC4=CC=CC=C4.Br

Isomeric SMILES

CC1=C(C=C(S1)C(=O)OC)C2=CSC(=N2)NC3=CC=C(C=C3)OC4=CC=CC=C4.Br

InChI

InChI=1S/C22H18N2O3S2.BrH/c1-14-18(12-20(29-14)21(25)26-2)19-13-28-22(24-19)23-15-8-10-17(11-9-15)27-16-6-4-3-5-7-16;/h3-13H,1-2H3,(H,23,24);1H