N,N-dimethyl-3-[4-(3-methylphenyl)-5-(oxolan-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]benzenesulfonamide

Systemtic Name: N,N-dimethyl-3-[4-(3-methylphenyl)-5-(oxolan-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]benzenesulfonamide Openeye Name: N,N-dimethyl-3-[4-(m-tolyl)-5-(tetrahydrofuran-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]benzenesulfonamide CAS Name: N,N-dimethyl-3-[4-(3-methylphenyl)-5-(2-oxolanylmethylthio)-1,2,4-triazol-3-yl]benzenesulfonamide IUPAC Name: N,N-dimethyl-3-[4-(3-methylphenyl)-5-(oxolan-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]benzenesulfonamide Traditional Name: N,N-dimethyl-3-[4-(m-tolyl)-5-(tetrahydrofurfurylthio)-1,2,4-triazol-3-yl]benzenesulfonamide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SCC3CCCO3)C4=CC(=CC=C4)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SCC3CCCO3)C4=CC(=CC=C4)S(=O)(=O)N(C)C

InChI

InChI=1S/C22H26N4O3S2/c1-16-7-4-9-18(13-16)26-21(23-24-22(26)30-15-19-10-6-12-29-19)17-8-5-11-20(14-17)31(27,28)25(2)3/h4-5,7-9,11,13-14,19H,6,10,12,15H2,1-3H3