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

Systemtic Name: 2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazole Openeye Name: 2-[(1-tert-butyltetrazol-5-yl)sulfanylmethyl]-1-ethyl-5-(1-piperidylsulfonyl)benzimidazole CAS Name: 2-[[(1-tert-butyl-5-tetrazolyl)thio]methyl]-1-ethyl-5-(1-piperidinylsulfonyl)benzimidazole IUPAC Name: 2-[(1-tert-butyltetrazol-5-yl)sulfanylmethyl]-1-ethyl-5-piperidin-1-ylsulfonylbenzimidazole Traditional Name: 2-[[(1-tert-butyltetrazol-5-yl)thio]methyl]-1-ethyl-5-piperidinosulfonyl-benzimidazole Formula: C20H29N7O2S2 MolecularWeight: 463.61996

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSC4=NN=NN4C(C)(C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSC4=NN=NN4C(C)(C)C

InChI

InChI=1S/C20H29N7O2S2/c1-5-26-17-10-9-15(31(28,29)25-11-7-6-8-12-25)13-16(17)21-18(26)14-30-19-22-23-24-27(19)20(2,3)4/h9-10,13H,5-8,11-12,14H2,1-4H3