3-[4-butan-2-yl-5-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 3-[4-butan-2-yl-5-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 3-[5-(3,3-dimethyl-2-oxo-butyl)sulfanyl-4-sec-butyl-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide CAS Name: 3-[4-butan-2-yl-5-[(3,3-dimethyl-2-oxobutyl)thio]-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[4-butan-2-yl-5-(3,3-dimethyl-2-oxobutyl)sulfanyl-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide Traditional Name: N,N-diethyl-3-[5-[(2-keto-3,3-dimethyl-butyl)thio]-4-sec-butyl-1,2,4-triazol-3-yl]benzenesulfonamide Formula: C22H34N4O3S2 MolecularWeight: 466.66036

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=NN=C1SCC(=O)C(C)(C)C)C2=CC(=CC=C2)S(=O)(=O)N(CC)CC

Isomeric SMILES

CCC(C)N1C(=NN=C1SCC(=O)C(C)(C)C)C2=CC(=CC=C2)S(=O)(=O)N(CC)CC

InChI

InChI=1S/C22H34N4O3S2/c1-8-16(4)26-20(23-24-21(26)30-15-19(27)22(5,6)7)17-12-11-13-18(14-17)31(28,29)25(9-2)10-3/h11-14,16H,8-10,15H2,1-7H3