1-ethyl-N,N-dimethyl-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-ethyl-N,N-dimethyl-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]benzimidazole-5-sulfonamide Openeye Name: 1-ethyl-N,N-dimethyl-2-[[4-propyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzimidazole-5-sulfonamide CAS Name: 1-ethyl-N,N-dimethyl-2-[[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-ethyl-N,N-dimethyl-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]benzimidazole-5-sulfonamide Traditional Name: 1-ethyl-N,N-dimethyl-2-[[[4-propyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]benzimidazole-5-sulfonamide Formula: C22H27N7O2S2 MolecularWeight: 485.62548

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC2=NC3=C(N2CC)C=CC(=C3)S(=O)(=O)N(C)C)C4=CC=NC=C4

Isomeric SMILES

CCCN1C(=NN=C1SCC2=NC3=C(N2CC)C=CC(=C3)S(=O)(=O)N(C)C)C4=CC=NC=C4

InChI

InChI=1S/C22H27N7O2S2/c1-5-13-29-21(16-9-11-23-12-10-16)25-26-22(29)32-15-20-24-18-14-17(33(30,31)27(3)4)7-8-19(18)28(20)6-2/h7-12,14H,5-6,13,15H2,1-4H3