[4-[(E)-[(4-oxidanylidene-1,3-thiazol-2-yl)hydrazinylidene]methyl]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-[(E)-[(4-oxidanylidene-1,3-thiazol-2-yl)hydrazinylidene]methyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [4-[(E)-[(4-oxothiazol-2-yl)hydrazono]methyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-[(E)-[(4-oxo-2-thiazolyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(4-oxo-1,3-thiazol-2-yl)hydrazinylidene]methyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-[(E)-[(4-keto-2-thiazolin-2-yl)hydrazono]methyl]phenyl] ester Formula: C17H15N3O4S2 MolecularWeight: 389.4487

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=NNC3=NC(=O)CS3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)/C=N/NC3=NC(=O)CS3

InChI

InChI=1S/C17H15N3O4S2/c1-12-2-8-15(9-3-12)26(22,23)24-14-6-4-13(5-7-14)10-18-20-17-19-16(21)11-25-17/h2-10H,11H2,1H3,(H,19,20,21)/b18-10+