N-[(2S)-4-methyl-1-[(2S)-2-(4-phenylbutylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]pyridine-3-carboxamide

Systemtic Name: N-[(2S)-4-methyl-1-[(2S)-2-(4-phenylbutylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]pyridine-3-carboxamide Openeye Name: N-[(1S)-3-methyl-1-[[(2S)-2-(4-phenylbutylcarbamoyl)pyrrolidin-1-yl]methyl]butyl]pyridine-3-carboxamide CAS Name: N-[(2S)-4-methyl-1-[(2S)-2-[oxo-(4-phenylbutylamino)methyl]-1-pyrrolidinyl]pentan-2-yl]-3-pyridinecarboxamide IUPAC Name: N-[(2S)-4-methyl-1-[(2S)-2-(4-phenylbutylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]pyridine-3-carboxamide Traditional Name: N-[(1S)-3-methyl-1-[[(2S)-2-(4-phenylbutylcarbamoyl)pyrrolidino]methyl]butyl]nicotinamide Formula: C27H38N4O2 MolecularWeight: 450.61622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CN1CCCC1C(=O)NCCCCC2=CC=CC=C2)NC(=O)C3=CN=CC=C3

Isomeric SMILES

CC(C)C[C@@H](CN1CCC[C@H]1C(=O)NCCCCC2=CC=CC=C2)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C27H38N4O2/c1-21(2)18-24(30-26(32)23-13-8-15-28-19-23)20-31-17-9-14-25(31)27(33)29-16-7-6-12-22-10-4-3-5-11-22/h3-5,8,10-11,13,15,19,21,24-25H,6-7,9,12,14,16-18,20H2,1-2H3,(H,29,33)(H,30,32)/t24-,25-/m0/s1