2-methyl-5-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]sulfanyl]benzoic acid

Systemtic Name: 2-methyl-5-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]sulfanyl]benzoic acid Openeye Name: 2-methyl-5-[2-(2-pyridylamino)thiazol-5-yl]sulfanyl-benzoic acid CAS Name: 2-methyl-5-[[2-(2-pyridinylamino)-5-thiazolyl]thio]benzoic acid IUPAC Name: 2-methyl-5-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]sulfanyl]benzoic acid Traditional Name: 2-methyl-5-[[2-(2-pyridylamino)thiazol-5-yl]thio]benzoic acid Formula: C16H13N3O2S2 MolecularWeight: 343.42332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=CN=C(S2)NC3=CC=CC=N3)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=CN=C(S2)NC3=CC=CC=N3)C(=O)O

InChI

InChI=1S/C16H13N3O2S2/c1-10-5-6-11(8-12(10)15(20)21)22-14-9-18-16(23-14)19-13-4-2-3-7-17-13/h2-9H,1H3,(H,20,21)(H,17,18,19)