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

Systemtic Name: N-[4-[tert-butylcarbamoyl(4-oxidanylbutyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-2-(quinolin-2-ylcarbonylamino)butanediamide Openeye Name: N-[1-benzyl-3-[tert-butylcarbamoyl(4-hydroxybutyl)amino]-2-hydroxy-propyl]-2-(quinoline-2-carbonylamino)butanediamide CAS Name: N-[4-[[(tert-butylamino)-oxomethyl]-(4-hydroxybutyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-2-[[oxo(2-quinolinyl)methyl]amino]butanediamide IUPAC Name: N-[4-[tert-butylcarbamoyl(4-hydroxybutyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-2-(quinoline-2-carbonylamino)butanediamide Traditional Name: N-[1-benzyl-3-[tert-butylcarbamoyl(4-hydroxybutyl)amino]-2-hydroxy-propyl]-2-(quinaldoylamino)succinamide Formula: C33H44N6O6 MolecularWeight: 620.73906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)N(CCCCO)CC(C(CC1=CC=CC=C1)NC(=O)C(CC(=O)N)NC(=O)C2=NC3=CC=CC=C3C=C2)O

Isomeric SMILES

CC(C)(C)NC(=O)N(CCCCO)CC(C(CC1=CC=CC=C1)NC(=O)C(CC(=O)N)NC(=O)C2=NC3=CC=CC=C3C=C2)O

InChI

InChI=1S/C33H44N6O6/c1-33(2,3)38-32(45)39(17-9-10-18-40)21-28(41)26(19-22-11-5-4-6-12-22)36-31(44)27(20-29(34)42)37-30(43)25-16-15-23-13-7-8-14-24(23)35-25/h4-8,11-16,26-28,40-41H,9-10,17-21H2,1-3H3,(H2,34,42)(H,36,44)(H,37,43)(H,38,45)