4-[[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]amino]benzenesulfonic acid

Systemtic Name: 4-[[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]amino]benzenesulfonic acid Openeye Name: 4-[[4-(4-chlorophenyl)-5-methyl-thiazol-2-yl]amino]benzenesulfonic acid CAS Name: 4-[[4-(4-chlorophenyl)-5-methyl-2-thiazolyl]amino]benzenesulfonic acid IUPAC Name: 4-[[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]amino]benzenesulfonic acid Traditional Name: 4-[[4-(4-chlorophenyl)-5-methyl-thiazol-2-yl]amino]besylic acid Formula: C16H13ClN2O3S2 MolecularWeight: 380.86902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC2=CC=C(C=C2)S(=O)(=O)O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(N=C(S1)NC2=CC=C(C=C2)S(=O)(=O)O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN2O3S2/c1-10-15(11-2-4-12(17)5-3-11)19-16(23-10)18-13-6-8-14(9-7-13)24(20,21)22/h2-9H,1H3,(H,18,19)(H,20,21,22)