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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(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

CC(C)CN(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/c1-21(2)19-39(31(44)38-32(3,4)5)20-27(40)24(17-22-11-7-6-8-12-22)33(30(35)43,18-28(34)41)37-29(42)26-16-15-23-13-9-10-14-25(23)36-26/h6-16,21,24,27,40H,17-20H2,1-5H3,(H2,34,41)(H2,35,43)(H,37,42)(H,38,44)