(2S)-1-[(2S)-4-methyl-2-(4-methylpentanoylamino)pentyl]-N-(4-phenylbutyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[(2S)-4-methyl-2-(4-methylpentanoylamino)pentyl]-N-(4-phenylbutyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[(2S)-4-methyl-2-(4-methylpentanoylamino)pentyl]-N-(4-phenylbutyl)pyrrolidine-2-carboxamide CAS Name: (2S)-1-[(2S)-4-methyl-2-[(4-methyl-1-oxopentyl)amino]pentyl]-N-(4-phenylbutyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[(2S)-4-methyl-2-(4-methylpentanoylamino)pentyl]-N-(4-phenylbutyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-1-[(2S)-4-methyl-2-(4-methylpentanoylamino)pentyl]-N-(4-phenylbutyl)pyrrolidine-2-carboxamide Formula: C27H45N3O2 MolecularWeight: 443.6651

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)NC(CC(C)C)CN1CCCC1C(=O)NCCCCC2=CC=CC=C2

Isomeric SMILES

CC(C)CCC(=O)N[C@@H](CC(C)C)CN1CCC[C@H]1C(=O)NCCCCC2=CC=CC=C2

InChI

InChI=1S/C27H45N3O2/c1-21(2)15-16-26(31)29-24(19-22(3)4)20-30-18-10-14-25(30)27(32)28-17-9-8-13-23-11-6-5-7-12-23/h5-7,11-12,21-22,24-25H,8-10,13-20H2,1-4H3,(H,28,32)(H,29,31)/t24-,25-/m0/s1