N,N-diethyl-3-[4-(2-methylpropyl)-5-(2-oxidanylidenepropylsulfanyl)-1,2,4-triazol-3-yl]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-[4-(2-methylpropyl)-5-(2-oxidanylidenepropylsulfanyl)-1,2,4-triazol-3-yl]benzenesulfonamide Openeye Name: 3-(5-acetonylsulfanyl-4-isobutyl-1,2,4-triazol-3-yl)-N,N-diethyl-benzenesulfonamide CAS Name: N,N-diethyl-3-[4-(2-methylpropyl)-5-(2-oxopropylthio)-1,2,4-triazol-3-yl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-[4-(2-methylpropyl)-5-(2-oxopropylsulfanyl)-1,2,4-triazol-3-yl]benzenesulfonamide Traditional Name: 3-[5-(acetonylthio)-4-isobutyl-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide Formula: C19H28N4O3S2 MolecularWeight: 424.58062

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(N2CC(C)C)SCC(=O)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(N2CC(C)C)SCC(=O)C

InChI

InChI=1S/C19H28N4O3S2/c1-6-22(7-2)28(25,26)17-10-8-9-16(11-17)18-20-21-19(27-13-15(5)24)23(18)12-14(3)4/h8-11,14H,6-7,12-13H2,1-5H3