2-[[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]carbamoyl]benzoic acid

Systemtic Name: 2-[[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]carbamoyl]benzoic acid Openeye Name: 2-[[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]carbamoyl]benzoic acid CAS Name: 2-[[[4-(4-bromophenyl)-5-methyl-2-thiazolyl]amino]-oxomethyl]benzoic acid IUPAC Name: 2-[[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]carbamoyl]benzoic acid Traditional Name: 2-[[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]carbamoyl]benzoic acid Formula: C18H13BrN2O3S MolecularWeight: 417.27642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)C2=CC=CC=C2C(=O)O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)C2=CC=CC=C2C(=O)O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H13BrN2O3S/c1-10-15(11-6-8-12(19)9-7-11)20-18(25-10)21-16(22)13-4-2-3-5-14(13)17(23)24/h2-9H,1H3,(H,23,24)(H,20,21,22)