1-ethyl-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-piperidin-1-ylsulfonyl-benzimidazole

Systemtic Name: 1-ethyl-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-piperidin-1-ylsulfonyl-benzimidazole Openeye Name: 1-ethyl-2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-(1-piperidylsulfonyl)benzimidazole CAS Name: 1-ethyl-2-[[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]-5-(1-piperidinylsulfonyl)benzimidazole IUPAC Name: 1-ethyl-2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-piperidin-1-ylsulfonylbenzimidazole Traditional Name: 1-ethyl-2-[[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]methyl]-5-piperidinosulfonyl-benzimidazole Formula: C24H28N6O2S2 MolecularWeight: 496.64812

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSC4=NN=CN4C5=CC=CC=C5C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSC4=NN=CN4C5=CC=CC=C5C

InChI

InChI=1S/C24H28N6O2S2/c1-3-29-22-12-11-19(34(31,32)28-13-7-4-8-14-28)15-20(22)26-23(29)16-33-24-27-25-17-30(24)21-10-6-5-9-18(21)2/h5-6,9-12,15,17H,3-4,7-8,13-14,16H2,1-2H3