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-[(3-methylcyclohexyl)carbonylamino]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-[(3-methylcyclohexyl)carbonylamino]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-cyclohexyl-2-[(3-methylcyclohexanecarbonyl)amino]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-[[(3-methylcyclohexyl)-oxomethyl]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-cyclohexyl-2-[(3-methylcyclohexanecarbonyl)amino]acetyl]-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-cyclohexyl-2-[(3-methylcyclohexanecarbonyl)amino]acetyl]pyrrolidine-2-carboxamide Formula: C48H75N7O9 MolecularWeight: 894.1506

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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)C3CCCC(C3)C)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)C3CCCC(C3)C)OCC4=CC=CC=C4

InChI

InChI=1S/C48H75N7O9/c1-5-8-24-37(43(49)58)53-45(60)38(25-9-6-2)51-40(56)28-50-47(62)42(57)36(17-7-3)52-46(61)39-27-35(64-30-32-19-12-10-13-20-32)29-55(39)48(63)41(33-21-14-11-15-22-33)54-44(59)34-23-16-18-31(4)26-34/h10,12-13,19-20,31,33-39,41H,5-9,11,14-18,21-30H2,1-4H3,(H2,49,58)(H,50,62)(H,51,56)(H,52,61)(H,53,60)(H,54,59)