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

Systemtic Name: 2-[4-[butyl(tert-butylcarbamoyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-2-(quinolin-2-ylcarbonylamino)butanediamide Openeye Name: 2-[1-benzyl-3-[butyl(tert-butylcarbamoyl)amino]-2-hydroxy-propyl]-2-(quinoline-2-carbonylamino)butanediamide CAS Name: 2-[4-[butyl-[(tert-butylamino)-oxomethyl]amino]-3-hydroxy-1-phenylbutan-2-yl]-2-[[oxo(2-quinolinyl)methyl]amino]butanediamide IUPAC Name: 2-[4-[butyl(tert-butylcarbamoyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-2-(quinoline-2-carbonylamino)butanediamide Traditional Name: 2-[1-benzyl-3-[butyl(tert-butylcarbamoyl)amino]-2-hydroxy-propyl]-2-(quinaldoylamino)succinamide Formula: C33H44N6O5 MolecularWeight: 604.73966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H44N6O5/c1-5-6-18-39(31(44)38-32(2,3)4)21-27(40)24(19-22-12-8-7-9-13-22)33(30(35)43,20-28(34)41)37-29(42)26-17-16-23-14-10-11-15-25(23)36-26/h7-17,24,27,40H,5-6,18-21H2,1-4H3,(H2,34,41)(H2,35,43)(H,37,42)(H,38,44)