3-[4-butan-2-yl-5-[(3-cyanophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 3-[4-butan-2-yl-5-[(3-cyanophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 3-[5-[(3-cyanophenyl)methylsulfanyl]-4-sec-butyl-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide CAS Name: 3-[4-butan-2-yl-5-[(3-cyanophenyl)methylthio]-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[4-butan-2-yl-5-[(3-cyanophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide Traditional Name: 3-[5-[(3-cyanobenzyl)thio]-4-sec-butyl-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide Formula: C24H29N5O2S2 MolecularWeight: 483.64936

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=NN=C1SCC2=CC=CC(=C2)C#N)C3=CC(=CC=C3)S(=O)(=O)N(CC)CC

Isomeric SMILES

CCC(C)N1C(=NN=C1SCC2=CC=CC(=C2)C#N)C3=CC(=CC=C3)S(=O)(=O)N(CC)CC

InChI

InChI=1S/C24H29N5O2S2/c1-5-18(4)29-23(21-12-9-13-22(15-21)33(30,31)28(6-2)7-3)26-27-24(29)32-17-20-11-8-10-19(14-20)16-25/h8-15,18H,5-7,17H2,1-4H3