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

Systemtic Name: N-[4-[tert-butylcarbamoyl(propyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-2-(quinolin-2-ylcarbonylamino)butanediamide Openeye Name: N-[1-benzyl-3-[tert-butylcarbamoyl(propyl)amino]-2-hydroxy-propyl]-2-(quinoline-2-carbonylamino)butanediamide CAS Name: N-[4-[[(tert-butylamino)-oxomethyl]-propylamino]-3-hydroxy-1-phenylbutan-2-yl]-2-[[oxo(2-quinolinyl)methyl]amino]butanediamide IUPAC Name: N-[4-[tert-butylcarbamoyl(propyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-2-(quinoline-2-carbonylamino)butanediamide Traditional Name: N-[1-benzyl-3-[tert-butylcarbamoyl(propyl)amino]-2-hydroxy-propyl]-2-(quinaldoylamino)succinamide Formula: C32H42N6O5 MolecularWeight: 590.71308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H42N6O5/c1-5-17-38(31(43)37-32(2,3)4)20-27(39)25(18-21-11-7-6-8-12-21)35-30(42)26(19-28(33)40)36-29(41)24-16-15-22-13-9-10-14-23(22)34-24/h6-16,25-27,39H,5,17-20H2,1-4H3,(H2,33,40)(H,35,42)(H,36,41)(H,37,43)