N-[4-[[1-(4-methoxyphenyl)-4-methyl-2-oxidanylidene-pentan-3-yl]-(2-morpholin-4-ylethylcarbamoyl)amino]-1-phenyl-butyl]-3-methyl-2-(2-morpholin-4-ylethylcarbamoylamino)-2-oxidanyl-butanamide

Systemtic Name: N-[4-[[1-(4-methoxyphenyl)-4-methyl-2-oxidanylidene-pentan-3-yl]-(2-morpholin-4-ylethylcarbamoyl)amino]-1-phenyl-butyl]-3-methyl-2-(2-morpholin-4-ylethylcarbamoylamino)-2-oxidanyl-butanamide Openeye Name: 2-hydroxy-N-[4-[[1-isopropyl-3-(4-methoxyphenyl)-2-oxo-propyl]-(2-morpholinoethylcarbamoyl)amino]-1-phenyl-butyl]-3-methyl-2-(2-morpholinoethylcarbamoylamino)butanamide CAS Name: 2-hydroxy-N-[4-[[1-(4-methoxyphenyl)-4-methyl-2-oxopentan-3-yl]-[[2-(4-morpholinyl)ethylamino]-oxomethyl]amino]-1-phenylbutyl]-3-methyl-2-[[[2-(4-morpholinyl)ethylamino]-oxomethyl]amino]butanamide IUPAC Name: 2-hydroxy-N-[4-[[1-(4-methoxyphenyl)-4-methyl-2-oxopentan-3-yl]-(2-morpholin-4-ylethylcarbamoyl)amino]-1-phenylbutyl]-3-methyl-2-(2-morpholin-4-ylethylcarbamoylamino)butanamide Traditional Name: 2-hydroxy-N-[4-[[1-isopropyl-2-keto-3-(4-methoxyphenyl)propyl]-(2-morpholinoethylcarbamoyl)amino]-1-phenyl-butyl]-3-methyl-2-(2-morpholinoethylcarbamoylamino)butyramide Formula: C42H65N7O8 MolecularWeight: 796.0076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)CC1=CC=C(C=C1)OC)N(CCCC(C2=CC=CC=C2)NC(=O)C(C(C)C)(NC(=O)NCCN3CCOCC3)O)C(=O)NCCN4CCOCC4

Isomeric SMILES

CC(C)C(C(=O)CC1=CC=C(C=C1)OC)N(CCCC(C2=CC=CC=C2)NC(=O)C(C(C)C)(NC(=O)NCCN3CCOCC3)O)C(=O)NCCN4CCOCC4

InChI

InChI=1S/C42H65N7O8/c1-31(2)38(37(50)30-33-13-15-35(55-5)16-14-33)49(41(53)44-18-21-48-24-28-57-29-25-48)19-9-12-36(34-10-7-6-8-11-34)45-39(51)42(54,32(3)4)46-40(52)43-17-20-47-22-26-56-27-23-47/h6-8,10-11,13-16,31-32,36,38,54H,9,12,17-30H2,1-5H3,(H,44,53)(H,45,51)(H2,43,46,52)