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

Systemtic Name: 5-[(3S)-3-(1H-benzimidazol-2-yl)piperidin-1-yl]carbonyl-N-butyl-4-oxidanylidene-1-propan-2-yl-pyridine-3-carboxamide Openeye Name: 5-[(3S)-3-(1H-benzimidazol-2-yl)piperidine-1-carbonyl]-N-butyl-1-isopropyl-4-oxo-pyridine-3-carboxamide CAS Name: 5-[[(3S)-3-(1H-benzimidazol-2-yl)-1-piperidinyl]-oxomethyl]-N-butyl-4-oxo-1-propan-2-yl-3-pyridinecarboxamide IUPAC Name: 5-[(3S)-3-(1H-benzimidazol-2-yl)piperidine-1-carbonyl]-N-butyl-4-oxo-1-propan-2-ylpyridine-3-carboxamide Traditional Name: 5-[(3S)-3-(1H-benzimidazol-2-yl)piperidine-1-carbonyl]-N-butyl-1-isopropyl-4-keto-nicotinamide Formula: C26H33N5O3 MolecularWeight: 463.57192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4N3)C(C)C

Isomeric SMILES

CCCCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCC[C@@H](C2)C3=NC4=CC=CC=C4N3)C(C)C

InChI

InChI=1S/C26H33N5O3/c1-4-5-12-27-25(33)19-15-31(17(2)3)16-20(23(19)32)26(34)30-13-8-9-18(14-30)24-28-21-10-6-7-11-22(21)29-24/h6-7,10-11,15-18H,4-5,8-9,12-14H2,1-3H3,(H,27,33)(H,28,29)/t18-/m0/s1