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

Systemtic Name: 3-[(2-azanyl-1,3-thiazol-5-yl)sulfanyl]-4-methyl-benzoic acid Openeye Name: 3-(2-aminothiazol-5-yl)sulfanyl-4-methyl-benzoic acid CAS Name: 3-[(2-amino-5-thiazolyl)thio]-4-methylbenzoic acid IUPAC Name: 3-[(2-amino-1,3-thiazol-5-yl)sulfanyl]-4-methylbenzoic acid Traditional Name: 3-[(2-aminothiazol-5-yl)thio]-4-methyl-benzoic acid Formula: C11H10N2O2S2 MolecularWeight: 266.3393

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)SC2=CN=C(S2)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)SC2=CN=C(S2)N

InChI

InChI=1S/C11H10N2O2S2/c1-6-2-3-7(10(14)15)4-8(6)16-9-5-13-11(12)17-9/h2-5H,1H3,(H2,12,13)(H,14,15)