N-[1-(4-methylpentyl)-2-(4-phenylbutylcarbamoyl)pyrrolidin-2-yl]pyridine-3-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCN1CCCC1(C(=O)NCCCCC2=CC=CC=C2)NC(=O)C3=CN=CC=C3

Isomeric SMILES

CC(C)CCCN1CCCC1(C(=O)NCCCCC2=CC=CC=C2)NC(=O)C3=CN=CC=C3

InChI

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