N-[3-oxidanyl-1-phenyl-4-[(phenylmethyl)-pyrrolidin-1-ylcarbonyl-amino]butan-2-yl]-2-(quinolin-2-ylcarbonylamino)butanediamide

Systemtic Name: N-[3-oxidanyl-1-phenyl-4-[(phenylmethyl)-pyrrolidin-1-ylcarbonyl-amino]butan-2-yl]-2-(quinolin-2-ylcarbonylamino)butanediamide Openeye Name: N-[1-benzyl-3-[benzyl(pyrrolidine-1-carbonyl)amino]-2-hydroxy-propyl]-2-(quinoline-2-carbonylamino)butanediamide CAS Name: N-[3-hydroxy-4-[[oxo(1-pyrrolidinyl)methyl]-(phenylmethyl)amino]-1-phenylbutan-2-yl]-2-[[oxo(2-quinolinyl)methyl]amino]butanediamide IUPAC Name: N-[4-[benzyl(pyrrolidine-1-carbonyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-2-(quinoline-2-carbonylamino)butanediamide Traditional Name: N-[1-benzyl-3-[benzyl(pyrrolidine-1-carbonyl)amino]-2-hydroxy-propyl]-2-(quinaldoylamino)succinamide Formula: C36H40N6O5 MolecularWeight: 636.74

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)N(CC2=CC=CC=C2)CC(C(CC3=CC=CC=C3)NC(=O)C(CC(=O)N)NC(=O)C4=NC5=CC=CC=C5C=C4)O

Isomeric SMILES

C1CCN(C1)C(=O)N(CC2=CC=CC=C2)CC(C(CC3=CC=CC=C3)NC(=O)C(CC(=O)N)NC(=O)C4=NC5=CC=CC=C5C=C4)O

InChI

InChI=1S/C36H40N6O5/c37-33(44)22-31(40-34(45)29-18-17-27-15-7-8-16-28(27)38-29)35(46)39-30(21-25-11-3-1-4-12-25)32(43)24-42(23-26-13-5-2-6-14-26)36(47)41-19-9-10-20-41/h1-8,11-18,30-32,43H,9-10,19-24H2,(H2,37,44)(H,39,46)(H,40,45)