N,N-diethyl-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3H-benzimidazole-5-sulfonamide

Systemtic Name: N,N-diethyl-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3H-benzimidazole-5-sulfonamide Openeye Name: N,N-diethyl-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3H-benzimidazole-5-sulfonamide CAS Name: N,N-diethyl-2-[[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-3H-benzimidazole-5-sulfonamide IUPAC Name: N,N-diethyl-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3H-benzimidazole-5-sulfonamide Traditional Name: N,N-diethyl-2-[[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-3H-benzimidazole-5-sulfonamide Formula: C21H24N6O2S2 MolecularWeight: 456.58426

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=C(N2)CSC3=NN=C(N3C4=CC=CC=C4)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=C(N2)CSC3=NN=C(N3C4=CC=CC=C4)C

InChI

InChI=1S/C21H24N6O2S2/c1-4-26(5-2)31(28,29)17-11-12-18-19(13-17)23-20(22-18)14-30-21-25-24-15(3)27(21)16-9-7-6-8-10-16/h6-13H,4-5,14H2,1-3H3,(H,22,23)