N-[1-[[2-[(2-azanyl-2-oxidanylidene-1-phenyl-ethyl)amino]-2-oxidanylidene-ethyl]amino]-1,2-bis(oxidanylidene)heptan-3-yl]-1-[2-cyclohexyl-2-(2-cyclohexylethanoylamino)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)heptan-3-yl]-1-[2-cyclohexyl-2-(2-cyclohexylethanoylamino)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]pentyl]-4-benzyloxy-1-[2-cyclohexyl-2-[(2-cyclohexylacetyl)amino]acetyl]pyrrolidine-2-carboxamide CAS Name: N-[1-[[2-[(2-amino-2-oxo-1-phenylethyl)amino]-2-oxoethyl]amino]-1,2-dioxoheptan-3-yl]-1-[2-cyclohexyl-2-[(2-cyclohexyl-1-oxoethyl)amino]-1-oxoethyl]-4-phenylmethoxy-2-pyrrolidinecarboxamide IUPAC Name: N-[1-[[2-[(2-amino-2-oxo-1-phenylethyl)amino]-2-oxoethyl]amino]-1,2-dioxoheptan-3-yl]-1-[2-cyclohexyl-2-[(2-cyclohexylacetyl)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]pentyl]-4-benzoxy-1-[2-cyclohexyl-2-[(2-cyclohexylacetyl)amino]acetyl]pyrrolidine-2-carboxamide Formula: C45H62N6O8 MolecularWeight: 815.00918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)C(=O)NCC(=O)NC(C1=CC=CC=C1)C(=O)N)NC(=O)C2CC(CN2C(=O)C(C3CCCCC3)NC(=O)CC4CCCCC4)OCC5=CC=CC=C5

Isomeric SMILES

CCCCC(C(=O)C(=O)NCC(=O)NC(C1=CC=CC=C1)C(=O)N)NC(=O)C2CC(CN2C(=O)C(C3CCCCC3)NC(=O)CC4CCCCC4)OCC5=CC=CC=C5

InChI

InChI=1S/C45H62N6O8/c1-2-3-24-35(41(54)44(57)47-27-38(53)50-39(42(46)55)32-20-12-6-13-21-32)48-43(56)36-26-34(59-29-31-18-10-5-11-19-31)28-51(36)45(58)40(33-22-14-7-15-23-33)49-37(52)25-30-16-8-4-9-17-30/h5-6,10-13,18-21,30,33-36,39-40H,2-4,7-9,14-17,22-29H2,1H3,(H2,46,55)(H,47,57)(H,48,56)(H,49,52)(H,50,53)