4-[2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethoxy]benzenesulfonamide

Systemtic Name: 4-[2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethoxy]benzenesulfonamide Openeye Name: 4-[2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethoxy]benzenesulfonamide CAS Name: 4-[2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethoxy]benzenesulfonamide Traditional Name: 4-[2-[(5-keto-4-propyl-1H-1,2,4-triazol-3-yl)thio]ethoxy]benzenesulfonamide Formula: C13H18N4O4S2 MolecularWeight: 358.43642

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCCOC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CCCN1C(=O)NN=C1SCCOC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C13H18N4O4S2/c1-2-7-17-12(18)15-16-13(17)22-9-8-21-10-3-5-11(6-4-10)23(14,19)20/h3-6H,2,7-9H2,1H3,(H,15,18)(H2,14,19,20)