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

Systemtic Name: 3-[4-butan-2-yl-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: N,N-diethyl-3-[5-[(3-methoxyphenyl)methylsulfanyl]-4-sec-butyl-1,2,4-triazol-3-yl]benzenesulfonamide CAS Name: 3-[4-butan-2-yl-5-[(3-methoxyphenyl)methylthio]-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[4-butan-2-yl-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide Traditional Name: N,N-diethyl-3-[5-(m-anisylthio)-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=C1SCC2=CC(=CC=C2)OC)C3=CC(=CC=C3)S(=O)(=O)N(CC)CC

Isomeric SMILES

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

InChI

InChI=1S/C24H32N4O3S2/c1-6-18(4)28-23(20-12-10-14-22(16-20)33(29,30)27(7-2)8-3)25-26-24(28)32-17-19-11-9-13-21(15-19)31-5/h9-16,18H,6-8,17H2,1-5H3