3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)-N-(3-methylpyridin-2-yl)propanamide

Systemtic Name: 3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)-N-(3-methylpyridin-2-yl)propanamide Openeye Name: 3-[1-methyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]-N-(3-methyl-2-pyridyl)propanamide CAS Name: 3-[1-methyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]-N-(3-methyl-2-pyridinyl)propanamide IUPAC Name: 3-(1-methyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)-N-(3-methylpyridin-2-yl)propanamide Traditional Name: 3-(1-methyl-5-piperidinosulfonyl-benzimidazol-2-yl)-N-(3-methyl-2-pyridyl)propionamide Formula: C22H27N5O3S MolecularWeight: 441.54648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)NC(=O)CCC2=NC3=C(N2C)C=CC(=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(N=CC=C1)NC(=O)CCC2=NC3=C(N2C)C=CC(=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H27N5O3S/c1-16-7-6-12-23-22(16)25-21(28)11-10-20-24-18-15-17(8-9-19(18)26(20)2)31(29,30)27-13-4-3-5-14-27/h6-9,12,15H,3-5,10-11,13-14H2,1-2H3,(H,23,25,28)