3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)-N-(pyridin-4-ylmethyl)propanamide

Systemtic Name: 3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)-N-(pyridin-4-ylmethyl)propanamide Openeye Name: 3-[1-methyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]-N-(4-pyridylmethyl)propanamide CAS Name: 3-[1-methyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]-N-(pyridin-4-ylmethyl)propanamide IUPAC Name: 3-(1-methyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)-N-(pyridin-4-ylmethyl)propanamide Traditional Name: 3-(1-methyl-5-piperidinosulfonyl-benzimidazol-2-yl)-N-(4-pyridylmethyl)propionamide Formula: C22H27N5O3S MolecularWeight: 441.54648

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CCC(=O)NCC4=CC=NC=C4

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CCC(=O)NCC4=CC=NC=C4

InChI

InChI=1S/C22H27N5O3S/c1-26-20-6-5-18(31(29,30)27-13-3-2-4-14-27)15-19(20)25-21(26)7-8-22(28)24-16-17-9-11-23-12-10-17/h5-6,9-12,15H,2-4,7-8,13-14,16H2,1H3,(H,24,28)