4-methyl-N-[4-(1H-1,2,4-triazol-5-ylsulfanyl)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[4-(1H-1,2,4-triazol-5-ylsulfanyl)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzenesulfonamide Openeye Name: 4-methyl-N-[4-(1H-1,2,4-triazol-5-ylsulfanyl)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzenesulfonamide CAS Name: 4-methyl-N-[4-(1H-1,2,4-triazol-5-ylthio)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzenesulfonamide IUPAC Name: 4-methyl-N-[4-(1H-1,2,4-triazol-5-ylsulfanyl)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzenesulfonamide Traditional Name: 4-methyl-N-[4-(1H-1,2,4-triazol-5-ylthio)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzenesulfonamide Formula: C21H20N4O3S2 MolecularWeight: 440.5385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C3C(=C2)C4=C(O3)CCCC4)SC5=NC=NN5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C3C(=C2)C4=C(O3)CCCC4)SC5=NC=NN5

InChI

InChI=1S/C21H20N4O3S2/c1-13-6-8-15(9-7-13)30(26,27)25-14-10-17-16-4-2-3-5-18(16)28-20(17)19(11-14)29-21-22-12-23-24-21/h6-12,25H,2-5H2,1H3,(H,22,23,24)