[3-[(E)-[(5-butyl-4-oxidanylidene-1,3-thiazol-2-yl)hydrazinylidene]methyl]phenyl] benzenesulfonate

Systemtic Name: [3-[(E)-[(5-butyl-4-oxidanylidene-1,3-thiazol-2-yl)hydrazinylidene]methyl]phenyl] benzenesulfonate Openeye Name: [3-[(E)-[(5-butyl-4-oxo-thiazol-2-yl)hydrazono]methyl]phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [3-[(E)-[(5-butyl-4-oxo-2-thiazolyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [3-[(E)-[(5-butyl-4-oxo-1,3-thiazol-2-yl)hydrazinylidene]methyl]phenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [3-[(E)-[(5-butyl-4-keto-2-thiazolin-2-yl)hydrazono]methyl]phenyl] ester Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)N=C(S1)NN=CC2=CC(=CC=C2)OS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCC1C(=O)N=C(S1)N/N=C/C2=CC(=CC=C2)OS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O4S2/c1-2-3-12-18-19(24)22-20(28-18)23-21-14-15-8-7-9-16(13-15)27-29(25,26)17-10-5-4-6-11-17/h4-11,13-14,18H,2-3,12H2,1H3,(H,22,23,24)/b21-14+