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

Systemtic Name: 1-ethyl-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-piperidin-1-ylsulfonyl-benzimidazole Openeye Name: 1-ethyl-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-(1-piperidylsulfonyl)benzimidazole CAS Name: 1-ethyl-2-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]-5-(1-piperidinylsulfonyl)benzimidazole IUPAC Name: 1-ethyl-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-piperidin-1-ylsulfonylbenzimidazole Traditional Name: 1-ethyl-2-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]-5-piperidinosulfonyl-benzimidazole Formula: C18H24N6O2S2 MolecularWeight: 420.55216

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSC4=NN=CN4C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSC4=NN=CN4C

InChI

InChI=1S/C18H24N6O2S2/c1-3-24-16-8-7-14(28(25,26)23-9-5-4-6-10-23)11-15(16)20-17(24)12-27-18-21-19-13-22(18)2/h7-8,11,13H,3-6,9-10,12H2,1-2H3