N-[1-[[2-[(2-azanyl-2-oxidanylidene-1-phenyl-ethyl)amino]-2-oxidanylidene-ethyl]amino]-1,2-bis(oxidanylidene)hexan-3-yl]-1-[2-[[2,4-bis(trifluoromethyl)phenyl]carbonylamino]-2-cyclohexyl-ethanoyl]-4-phenylmethoxy-pyrrolidine-2-carboxamide

Systemtic Name: N-[1-[[2-[(2-azanyl-2-oxidanylidene-1-phenyl-ethyl)amino]-2-oxidanylidene-ethyl]amino]-1,2-bis(oxidanylidene)hexan-3-yl]-1-[2-[[2,4-bis(trifluoromethyl)phenyl]carbonylamino]-2-cyclohexyl-ethanoyl]-4-phenylmethoxy-pyrrolidine-2-carboxamide Openeye Name: N-[1-[2-[[2-[(2-amino-2-oxo-1-phenyl-ethyl)amino]-2-oxo-ethyl]amino]-2-oxo-acetyl]butyl]-4-benzyloxy-1-[2-[[2,4-bis(trifluoromethyl)benzoyl]amino]-2-cyclohexyl-acetyl]pyrrolidine-2-carboxamide CAS Name: N-[1-[[2-[(2-amino-2-oxo-1-phenylethyl)amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]-1-[2-[[[2,4-bis(trifluoromethyl)phenyl]-oxomethyl]amino]-2-cyclohexyl-1-oxoethyl]-4-phenylmethoxy-2-pyrrolidinecarboxamide IUPAC Name: N-[1-[[2-[(2-amino-2-oxo-1-phenylethyl)amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]-1-[2-[[2,4-bis(trifluoromethyl)benzoyl]amino]-2-cyclohexylacetyl]-4-phenylmethoxypyrrolidine-2-carboxamide Traditional Name: N-[1-[2-[[2-[(2-amino-2-keto-1-phenyl-ethyl)amino]-2-keto-ethyl]amino]-2-keto-acetyl]butyl]-4-benzoxy-1-[2-[[2,4-bis(trifluoromethyl)benzoyl]amino]-2-cyclohexyl-acetyl]pyrrolidine-2-carboxamide Formula: C45H50F6N6O8 MolecularWeight: 916.904319

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C(=O)NCC(=O)NC(C1=CC=CC=C1)C(=O)N)NC(=O)C2CC(CN2C(=O)C(C3CCCCC3)NC(=O)C4=C(C=C(C=C4)C(F)(F)F)C(F)(F)F)OCC5=CC=CC=C5

Isomeric SMILES

CCCC(C(=O)C(=O)NCC(=O)NC(C1=CC=CC=C1)C(=O)N)NC(=O)C2CC(CN2C(=O)C(C3CCCCC3)NC(=O)C4=C(C=C(C=C4)C(F)(F)F)C(F)(F)F)OCC5=CC=CC=C5

InChI

InChI=1S/C45H50F6N6O8/c1-2-12-33(38(59)42(63)53-23-35(58)55-36(39(52)60)27-15-8-4-9-16-27)54-41(62)34-22-30(65-25-26-13-6-3-7-14-26)24-57(34)43(64)37(28-17-10-5-11-18-28)56-40(61)31-20-19-29(44(46,47)48)21-32(31)45(49,50)51/h3-4,6-9,13-16,19-21,28,30,33-34,36-37H,2,5,10-12,17-18,22-25H2,1H3,(H2,52,60)(H,53,63)(H,54,62)(H,55,58)(H,56,61)