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

Systemtic Name: [4-[(E)-[(5-butyl-4-oxidanylidene-1,3-thiazol-2-yl)hydrazinylidene]methyl]phenyl] 4-iodanylbenzenesulfonate Openeye Name: [4-[(E)-[(5-butyl-4-oxo-thiazol-2-yl)hydrazono]methyl]phenyl] 4-iodobenzenesulfonate CAS Name: 4-iodobenzenesulfonic 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-iodobenzenesulfonate Traditional Name: 4-iodobenzenesulfonic acid [4-[(E)-[(5-butyl-4-keto-2-thiazolin-2-yl)hydrazono]methyl]phenyl] ester Formula: C20H20IN3O4S2 MolecularWeight: 557.42497

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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)I

Isomeric SMILES

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

InChI

InChI=1S/C20H20IN3O4S2/c1-2-3-4-18-19(25)23-20(29-18)24-22-13-14-5-9-16(10-6-14)28-30(26,27)17-11-7-15(21)8-12-17/h5-13,18H,2-4H2,1H3,(H,23,24,25)/b22-13+