1-ethyl-2-[(1-methylimidazol-2-yl)sulfanylmethyl]-5-piperidin-1-ylsulfonyl-benzimidazole

Systemtic Name: 1-ethyl-2-[(1-methylimidazol-2-yl)sulfanylmethyl]-5-piperidin-1-ylsulfonyl-benzimidazole Openeye Name: 1-ethyl-2-[(1-methylimidazol-2-yl)sulfanylmethyl]-5-(1-piperidylsulfonyl)benzimidazole CAS Name: 1-ethyl-2-[[(1-methyl-2-imidazolyl)thio]methyl]-5-(1-piperidinylsulfonyl)benzimidazole IUPAC Name: 1-ethyl-2-[(1-methylimidazol-2-yl)sulfanylmethyl]-5-piperidin-1-ylsulfonylbenzimidazole Traditional Name: 1-ethyl-2-[[(1-methylimidazol-2-yl)thio]methyl]-5-piperidinosulfonyl-benzimidazole Formula: C19H25N5O2S2 MolecularWeight: 419.5641

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N5O2S2/c1-3-24-17-8-7-15(28(25,26)23-10-5-4-6-11-23)13-16(17)21-18(24)14-27-19-20-9-12-22(19)2/h7-9,12-13H,3-6,10-11,14H2,1-2H3