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

Systemtic Name: [4-[(E)-[(5-butyl-4-oxidanylidene-1,3-thiazol-2-yl)hydrazinylidene]methyl]phenyl] 4-acetamidobenzenesulfonate Openeye Name: [4-[(E)-[(5-butyl-4-oxo-thiazol-2-yl)hydrazono]methyl]phenyl] 4-acetamidobenzenesulfonate CAS Name: 4-acetamidobenzenesulfonic acid [4-[(E)-[(5-butyl-4-oxo-2-thiazolyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(5-butyl-4-oxo-1,3-thiazol-2-yl)hydrazinylidene]methyl]phenyl] 4-acetamidobenzenesulfonate Traditional Name: 4-acetamidobenzenesulfonic acid [4-[(E)-[(5-butyl-4-keto-2-thiazolin-2-yl)hydrazono]methyl]phenyl] ester Formula: C22H24N4O5S2 MolecularWeight: 488.57976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O5S2/c1-3-4-5-20-21(28)25-22(32-20)26-23-14-16-6-10-18(11-7-16)31-33(29,30)19-12-8-17(9-13-19)24-15(2)27/h6-14,20H,3-5H2,1-2H3,(H,24,27)(H,25,26,28)/b23-14+