2-[4-[tert-butylcarbamoyl-(phenylmethyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-2-(quinolin-2-ylcarbonylamino)butanediamide

Systemtic Name: 2-[4-[tert-butylcarbamoyl-(phenylmethyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-2-(quinolin-2-ylcarbonylamino)butanediamide Openeye Name: 2-[1-benzyl-3-[benzyl(tert-butylcarbamoyl)amino]-2-hydroxy-propyl]-2-(quinoline-2-carbonylamino)butanediamide CAS Name: 2-[4-[[(tert-butylamino)-oxomethyl]-(phenylmethyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-2-[[oxo(2-quinolinyl)methyl]amino]butanediamide IUPAC Name: 2-[4-[benzyl(tert-butylcarbamoyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-2-(quinoline-2-carbonylamino)butanediamide Traditional Name: 2-[1-benzyl-3-[benzyl(tert-butylcarbamoyl)amino]-2-hydroxy-propyl]-2-(quinaldoylamino)succinamide Formula: C36H42N6O5 MolecularWeight: 638.75588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)N(CC1=CC=CC=C1)CC(C(CC2=CC=CC=C2)C(CC(=O)N)(C(=O)N)NC(=O)C3=NC4=CC=CC=C4C=C3)O

Isomeric SMILES

CC(C)(C)NC(=O)N(CC1=CC=CC=C1)CC(C(CC2=CC=CC=C2)C(CC(=O)N)(C(=O)N)NC(=O)C3=NC4=CC=CC=C4C=C3)O

InChI

InChI=1S/C36H42N6O5/c1-35(2,3)41-34(47)42(22-25-14-8-5-9-15-25)23-30(43)27(20-24-12-6-4-7-13-24)36(33(38)46,21-31(37)44)40-32(45)29-19-18-26-16-10-11-17-28(26)39-29/h4-19,27,30,43H,20-23H2,1-3H3,(H2,37,44)(H2,38,46)(H,40,45)(H,41,47)