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

Systemtic Name: 4-[2-(2-azanyl-4-methyl-1,3-thiazol-5-yl)-2-oxidanylidene-ethanehydrazonoyl]benzoic acid Openeye Name: 4-[2-(2-amino-4-methyl-thiazol-5-yl)-2-oxo-ethanehydrazonoyl]benzoic acid CAS Name: 4-[(1E)-2-(2-amino-4-methyl-5-thiazolyl)-1-hydrazinylidene-2-oxoethyl]benzoic acid IUPAC Name: 4-[2-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-oxoethanehydrazonoyl]benzoic acid Traditional Name: 4-[2-(2-amino-4-methyl-thiazol-5-yl)-2-keto-acetohydrazonoyl]benzoic acid Formula: C13H12N4O3S MolecularWeight: 304.32438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N)C(=O)C(=NN)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)N)C(=O)/C(=N/N)/C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H12N4O3S/c1-6-11(21-13(14)16-6)10(18)9(17-15)7-2-4-8(5-3-7)12(19)20/h2-5H,15H2,1H3,(H2,14,16)(H,19,20)/b17-9+