5-[(3S)-3-(1H-benzimidazol-2-yl)piperidin-1-yl]carbonyl-1-cyclopropyl-4-oxidanylidene-N-(phenylmethyl)pyridine-3-carboxamide

Systemtic Name: 5-[(3S)-3-(1H-benzimidazol-2-yl)piperidin-1-yl]carbonyl-1-cyclopropyl-4-oxidanylidene-N-(phenylmethyl)pyridine-3-carboxamide Openeye Name: 5-[(3S)-3-(1H-benzimidazol-2-yl)piperidine-1-carbonyl]-N-benzyl-1-cyclopropyl-4-oxo-pyridine-3-carboxamide CAS Name: 5-[[(3S)-3-(1H-benzimidazol-2-yl)-1-piperidinyl]-oxomethyl]-1-cyclopropyl-4-oxo-N-(phenylmethyl)-3-pyridinecarboxamide IUPAC Name: 5-[(3S)-3-(1H-benzimidazol-2-yl)piperidine-1-carbonyl]-N-benzyl-1-cyclopropyl-4-oxopyridine-3-carboxamide Traditional Name: 5-[(3S)-3-(1H-benzimidazol-2-yl)piperidine-1-carbonyl]-N-benzyl-1-cyclopropyl-4-keto-nicotinamide Formula: C29H29N5O3 MolecularWeight: 495.57226

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CN(C=C(C2=O)C(=O)NCC3=CC=CC=C3)C4CC4)C5=NC6=CC=CC=C6N5

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=CN(C=C(C2=O)C(=O)NCC3=CC=CC=C3)C4CC4)C5=NC6=CC=CC=C6N5

InChI

InChI=1S/C29H29N5O3/c35-26-22(28(36)30-15-19-7-2-1-3-8-19)17-34(21-12-13-21)18-23(26)29(37)33-14-6-9-20(16-33)27-31-24-10-4-5-11-25(24)32-27/h1-5,7-8,10-11,17-18,20-21H,6,9,12-16H2,(H,30,36)(H,31,32)/t20-/m0/s1