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

Systemtic Name: N-[1-[[2-[[1-[(1-azanyl-1-oxidanylidene-hexan-2-yl)amino]-1-oxidanylidene-hexan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-1,2-bis(oxidanylidene)hexan-3-yl]-1-[2-cyclohexyl-2-(cyclohexylcarbonylamino)ethanoyl]-4-phenylmethoxy-pyrrolidine-2-carboxamide Openeye Name: 4-benzyloxy-N-[1-[2-[[2-[1-(1-carbamoylpentylcarbamoyl)pentylamino]-2-oxo-ethyl]amino]-2-oxo-acetyl]butyl]-1-[2-(cyclohexanecarbonylamino)-2-cyclohexyl-acetyl]pyrrolidine-2-carboxamide CAS Name: N-[1-[[2-[[1-[(1-amino-1-oxohexan-2-yl)amino]-1-oxohexan-2-yl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]-1-[2-cyclohexyl-2-[[cyclohexyl(oxo)methyl]amino]-1-oxoethyl]-4-phenylmethoxy-2-pyrrolidinecarboxamide IUPAC Name: N-[1-[[2-[[1-[(1-amino-1-oxohexan-2-yl)amino]-1-oxohexan-2-yl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]-1-[2-(cyclohexanecarbonylamino)-2-cyclohexylacetyl]-4-phenylmethoxypyrrolidine-2-carboxamide Traditional Name: 4-benzoxy-N-[1-[2-[[2-[1-(1-carbamoylpentylcarbamoyl)pentylamino]-2-keto-ethyl]amino]-2-keto-acetyl]butyl]-1-[2-(cyclohexanecarbonylamino)-2-cyclohexyl-acetyl]pyrrolidine-2-carboxamide Formula: C47H73N7O9 MolecularWeight: 880.12402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)N)NC(=O)C(CCCC)NC(=O)CNC(=O)C(=O)C(CCC)NC(=O)C1CC(CN1C(=O)C(C2CCCCC2)NC(=O)C3CCCCC3)OCC4=CC=CC=C4

Isomeric SMILES

CCCCC(C(=O)N)NC(=O)C(CCCC)NC(=O)CNC(=O)C(=O)C(CCC)NC(=O)C1CC(CN1C(=O)C(C2CCCCC2)NC(=O)C3CCCCC3)OCC4=CC=CC=C4

InChI

InChI=1S/C47H73N7O9/c1-4-7-25-36(42(48)57)52-44(59)37(26-8-5-2)50-39(55)28-49-46(61)41(56)35(18-6-3)51-45(60)38-27-34(63-30-31-19-12-9-13-20-31)29-54(38)47(62)40(32-21-14-10-15-22-32)53-43(58)33-23-16-11-17-24-33/h9,12-13,19-20,32-38,40H,4-8,10-11,14-18,21-30H2,1-3H3,(H2,48,57)(H,49,61)(H,50,55)(H,51,60)(H,52,59)(H,53,58)