3-[4-butan-2-yl-5-(2-oxidanyl-2-phenyl-ethyl)sulfanyl-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 3-[4-butan-2-yl-5-(2-oxidanyl-2-phenyl-ethyl)sulfanyl-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: N,N-diethyl-3-[5-(2-hydroxy-2-phenyl-ethyl)sulfanyl-4-sec-butyl-1,2,4-triazol-3-yl]benzenesulfonamide CAS Name: 3-[4-butan-2-yl-5-[(2-hydroxy-2-phenylethyl)thio]-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[4-butan-2-yl-5-(2-hydroxy-2-phenylethyl)sulfanyl-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide Traditional Name: N,N-diethyl-3-[5-[(2-hydroxy-2-phenyl-ethyl)thio]-4-sec-butyl-1,2,4-triazol-3-yl]benzenesulfonamide Formula: C24H32N4O3S2 MolecularWeight: 488.66588

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=NN=C1SCC(C2=CC=CC=C2)O)C3=CC(=CC=C3)S(=O)(=O)N(CC)CC

Isomeric SMILES

CCC(C)N1C(=NN=C1SCC(C2=CC=CC=C2)O)C3=CC(=CC=C3)S(=O)(=O)N(CC)CC

InChI

InChI=1S/C24H32N4O3S2/c1-5-18(4)28-23(20-14-11-15-21(16-20)33(30,31)27(6-2)7-3)25-26-24(28)32-17-22(29)19-12-9-8-10-13-19/h8-16,18,22,29H,5-7,17H2,1-4H3