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

Systemtic Name: 2-[[4-azanyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[[4-amino-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide CAS Name: 2-[[[4-amino-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]methyl]-1-ethyl-N,N-dimethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[[4-amino-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1-ethyl-N,N-dimethylbenzimidazole-5-sulfonamide Traditional Name: 2-[[[4-amino-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]methyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide Formula: C20H22FN7O2S2 MolecularWeight: 475.562783

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CSC3=NN=C(N3N)C4=CC=CC=C4F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CSC3=NN=C(N3N)C4=CC=CC=C4F

InChI

InChI=1S/C20H22FN7O2S2/c1-4-27-17-10-9-13(32(29,30)26(2)3)11-16(17)23-18(27)12-31-20-25-24-19(28(20)22)14-7-5-6-8-15(14)21/h5-11H,4,12,22H2,1-3H3