(2R)-2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)propanamide

Systemtic Name: (2R)-2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)propanamide Openeye Name: (2R)-2-[4-(azepane-1-carbonyl)-1-piperidyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide CAS Name: (2R)-2-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide IUPAC Name: (2R)-2-[4-(azepane-1-carbonyl)piperidin-1-yl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide Traditional Name: (2R)-2-[4-(azepane-1-carbonyl)piperidino]-N-(2-keto-1,3-dihydrobenzimidazol-5-yl)propionamide Formula: C22H31N5O3 MolecularWeight: 413.51324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)N3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=C(C=C1)NC(=O)N2)N3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C22H31N5O3/c1-15(20(28)23-17-6-7-18-19(14-17)25-22(30)24-18)26-12-8-16(9-13-26)21(29)27-10-4-2-3-5-11-27/h6-7,14-16H,2-5,8-13H2,1H3,(H,23,28)(H2,24,25,30)/t15-/m1/s1