1-ethyl-2-[[1-(oxolan-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-5-piperidin-1-ylsulfonyl-benzimidazole

Systemtic Name: 1-ethyl-2-[[1-(oxolan-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-5-piperidin-1-ylsulfonyl-benzimidazole Openeye Name: 1-ethyl-5-(1-piperidylsulfonyl)-2-[[1-(tetrahydrofuran-2-ylmethyl)tetrazol-5-yl]sulfanylmethyl]benzimidazole CAS Name: 1-ethyl-2-[[[1-(2-oxolanylmethyl)-5-tetrazolyl]thio]methyl]-5-(1-piperidinylsulfonyl)benzimidazole IUPAC Name: 1-ethyl-2-[[1-(oxolan-2-ylmethyl)tetrazol-5-yl]sulfanylmethyl]-5-piperidin-1-ylsulfonylbenzimidazole Traditional Name: 1-ethyl-5-piperidinosulfonyl-2-[[[1-(tetrahydrofurfuryl)tetrazol-5-yl]thio]methyl]benzimidazole Formula: C21H29N7O3S2 MolecularWeight: 491.63006

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSC4=NN=NN4CC5CCCO5

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSC4=NN=NN4CC5CCCO5

InChI

InChI=1S/C21H29N7O3S2/c1-2-27-19-9-8-17(33(29,30)26-10-4-3-5-11-26)13-18(19)22-20(27)15-32-21-23-24-25-28(21)14-16-7-6-12-31-16/h8-9,13,16H,2-7,10-12,14-15H2,1H3