1-(azepan-1-yl)-3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)propan-1-one

Systemtic Name: 1-(azepan-1-yl)-3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)propan-1-one Openeye Name: 1-(azepan-1-yl)-3-[1-methyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]propan-1-one CAS Name: 1-(1-azepanyl)-3-[1-methyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]-1-propanone IUPAC Name: 1-(azepan-1-yl)-3-(1-methyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)propan-1-one Traditional Name: 1-(azepan-1-yl)-3-(1-methyl-5-piperidinosulfonyl-benzimidazol-2-yl)propan-1-one Formula: C22H32N4O3S MolecularWeight: 432.57948

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CCC(=O)N4CCCCCC4

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CCC(=O)N4CCCCCC4

InChI

InChI=1S/C22H32N4O3S/c1-24-20-10-9-18(30(28,29)26-15-7-4-8-16-26)17-19(20)23-21(24)11-12-22(27)25-13-5-2-3-6-14-25/h9-10,17H,2-8,11-16H2,1H3