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

Systemtic Name: N,N-diethyl-3-[4-(2-methylpropyl)-5-phenacylsulfanyl-1,2,4-triazol-3-yl]benzenesulfonamide Openeye Name: N,N-diethyl-3-(4-isobutyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)benzenesulfonamide CAS Name: N,N-diethyl-3-[4-(2-methylpropyl)-5-(phenacylthio)-1,2,4-triazol-3-yl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-[4-(2-methylpropyl)-5-phenacylsulfanyl-1,2,4-triazol-3-yl]benzenesulfonamide Traditional Name: N,N-diethyl-3-[4-isobutyl-5-(phenacylthio)-1,2,4-triazol-3-yl]benzenesulfonamide Formula: C24H30N4O3S2 MolecularWeight: 486.65

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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)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(N2CC(C)C)SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H30N4O3S2/c1-5-27(6-2)33(30,31)21-14-10-13-20(15-21)23-25-26-24(28(23)16-18(3)4)32-17-22(29)19-11-8-7-9-12-19/h7-15,18H,5-6,16-17H2,1-4H3