2-methyl-N'-[1-oxidanylidene-1-[2-(phenylazanylmethyl)pyrrolidin-1-yl]-3-(4-phenylmethoxyphenyl)propan-2-yl]pentanediamide

Systemtic Name: 2-methyl-N'-[1-oxidanylidene-1-[2-(phenylazanylmethyl)pyrrolidin-1-yl]-3-(4-phenylmethoxyphenyl)propan-2-yl]pentanediamide Openeye Name: N'-[2-[2-(anilinomethyl)pyrrolidin-1-yl]-1-[(4-benzyloxyphenyl)methyl]-2-oxo-ethyl]-2-methyl-pentanediamide CAS Name: N'-[1-[2-(anilinomethyl)-1-pyrrolidinyl]-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]-2-methylpentanediamide IUPAC Name: N'-[1-[2-(anilinomethyl)pyrrolidin-1-yl]-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]-2-methylpentanediamide Traditional Name: N'-[2-[2-(anilinomethyl)pyrrolidino]-1-(4-benzoxybenzyl)-2-keto-ethyl]-2-methyl-glutaramide Formula: C33H40N4O4 MolecularWeight: 556.6951

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)N3CCCC3CNC4=CC=CC=C4)C(=O)N

Isomeric SMILES

CC(CCC(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)N3CCCC3CNC4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C33H40N4O4/c1-24(32(34)39)14-19-31(38)36-30(21-25-15-17-29(18-16-25)41-23-26-9-4-2-5-10-26)33(40)37-20-8-13-28(37)22-35-27-11-6-3-7-12-27/h2-7,9-12,15-18,24,28,30,35H,8,13-14,19-23H2,1H3,(H2,34,39)(H,36,38)