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

Systemtic Name: N,N-diethyl-3-[4-(2-methylpropyl)-5-(3-oxidanylidenebutan-2-ylsulfanyl)-1,2,4-triazol-3-yl]benzenesulfonamide Openeye Name: N,N-diethyl-3-[4-isobutyl-5-(1-methyl-2-oxo-propyl)sulfanyl-1,2,4-triazol-3-yl]benzenesulfonamide CAS Name: N,N-diethyl-3-[4-(2-methylpropyl)-5-(3-oxobutan-2-ylthio)-1,2,4-triazol-3-yl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-[4-(2-methylpropyl)-5-(3-oxobutan-2-ylsulfanyl)-1,2,4-triazol-3-yl]benzenesulfonamide Traditional Name: N,N-diethyl-3-[4-isobutyl-5-[(2-keto-1-methyl-propyl)thio]-1,2,4-triazol-3-yl]benzenesulfonamide Formula: C20H30N4O3S2 MolecularWeight: 438.6072

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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)SC(C)C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C20H30N4O3S2/c1-7-23(8-2)29(26,27)18-11-9-10-17(12-18)19-21-22-20(24(19)13-14(3)4)28-16(6)15(5)25/h9-12,14,16H,7-8,13H2,1-6H3