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-[(2,6-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)heptan-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]pentyl]-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-dioxoheptan-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-dioxoheptan-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]pentyl]-4-benzoxy-1-[2-cyclohexyl-2-[(2,6-dimethylbenzoyl)amino]acetyl]pyrrolidine-2-carboxamide Formula: C46H58N6O8 MolecularWeight: 822.98812

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

InChI

InChI=1S/C46H58N6O8/c1-4-5-24-35(41(54)45(58)48-26-37(53)50-39(42(47)55)32-20-11-7-12-21-32)49-43(56)36-25-34(60-28-31-18-9-6-10-19-31)27-52(36)46(59)40(33-22-13-8-14-23-33)51-44(57)38-29(2)16-15-17-30(38)3/h6-7,9-12,15-21,33-36,39-40H,4-5,8,13-14,22-28H2,1-3H3,(H2,47,55)(H,48,58)(H,49,56)(H,50,53)(H,51,57)