N-[1-[[2-[(2-azanyl-2-oxidanylidene-1-phenyl-ethyl)amino]-2-oxidanylidene-ethyl]amino]-1,2-bis(oxidanylidene)hexan-3-yl]-1-[2-cyclohexyl-2-[(3-methylcyclohexyl)carbonylamino]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-cyclohexyl-2-[(3-methylcyclohexyl)carbonylamino]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-cyclohexyl-2-[(3-methylcyclohexanecarbonyl)amino]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-cyclohexyl-2-[[(3-methylcyclohexyl)-oxomethyl]amino]-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-cyclohexyl-2-[(3-methylcyclohexanecarbonyl)amino]acetyl]-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-cyclohexyl-2-[(3-methylcyclohexanecarbonyl)amino]acetyl]pyrrolidine-2-carboxamide Formula: C44H60N6O8 MolecularWeight: 800.9826

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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)C4CCCC(C4)C)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)C4CCCC(C4)C)OCC5=CC=CC=C5

InChI

InChI=1S/C44H60N6O8/c1-3-14-34(39(52)43(56)46-25-36(51)48-37(40(45)53)30-18-9-5-10-19-30)47-42(55)35-24-33(58-27-29-16-7-4-8-17-29)26-50(35)44(57)38(31-20-11-6-12-21-31)49-41(54)32-22-13-15-28(2)23-32/h4-5,7-10,16-19,28,31-35,37-38H,3,6,11-15,20-27H2,1-2H3,(H2,45,53)(H,46,56)(H,47,55)(H,48,51)(H,49,54)