N-[4-(3-ethylsulfanyl-5,5-dimethyl-1H-1,2,4-triazol-2-yl)phenyl]benzenesulfonamide

Systemtic Name: N-[4-(3-ethylsulfanyl-5,5-dimethyl-1H-1,2,4-triazol-2-yl)phenyl]benzenesulfonamide Openeye Name: N-[4-(3-ethylsulfanyl-5,5-dimethyl-1H-1,2,4-triazol-2-yl)phenyl]benzenesulfonamide CAS Name: N-[4-[3-(ethylthio)-5,5-dimethyl-1H-1,2,4-triazol-2-yl]phenyl]benzenesulfonamide IUPAC Name: N-[4-(3-ethylsulfanyl-5,5-dimethyl-1H-1,2,4-triazol-2-yl)phenyl]benzenesulfonamide Traditional Name: N-[4-[3-(ethylthio)-5,5-dimethyl-1H-1,2,4-triazol-2-yl]phenyl]benzenesulfonamide Formula: C18H22N4O2S2 MolecularWeight: 390.52288

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(NN1C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)(C)C

Isomeric SMILES

CCSC1=NC(NN1C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)(C)C

InChI

InChI=1S/C18H22N4O2S2/c1-4-25-17-19-18(2,3)21-22(17)15-12-10-14(11-13-15)20-26(23,24)16-8-6-5-7-9-16/h5-13,20-21H,4H2,1-3H3