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-[(2,6-dimethylphenyl)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-[(2,6-dimethylphenyl)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-[(2,6-dimethylbenzoyl)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-[[(2,6-dimethylphenyl)-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-[(2,6-dimethylbenzoyl)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-[(2,6-dimethylbenzoyl)amino]acetyl]pyrrolidine-2-carboxamide Formula: C45H56N6O8 MolecularWeight: 808.96154

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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=CC=C4C)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)C4=C(C=CC=C4C)C)OCC5=CC=CC=C5

InChI

InChI=1S/C45H56N6O8/c1-4-15-34(40(53)44(57)47-25-36(52)49-38(41(46)54)31-20-10-6-11-21-31)48-42(55)35-24-33(59-27-30-18-8-5-9-19-30)26-51(35)45(58)39(32-22-12-7-13-23-32)50-43(56)37-28(2)16-14-17-29(37)3/h5-6,8-11,14,16-21,32-35,38-39H,4,7,12-13,15,22-27H2,1-3H3,(H2,46,54)(H,47,57)(H,48,55)(H,49,52)(H,50,56)