N-[1-[2-(2-azanyl-2-oxidanylidene-1-phenyl-ethoxy)ethylamino]-1,2-bis(oxidanylidene)hexan-3-yl]-1-[2-cyclohexyl-2-[[4-methyl-2-(methylsulfonylamino)pentanoyl]amino]ethanoyl]-4-phenylmethoxy-pyrrolidine-2-carboxamide

Systemtic Name: N-[1-[2-(2-azanyl-2-oxidanylidene-1-phenyl-ethoxy)ethylamino]-1,2-bis(oxidanylidene)hexan-3-yl]-1-[2-cyclohexyl-2-[[4-methyl-2-(methylsulfonylamino)pentanoyl]amino]ethanoyl]-4-phenylmethoxy-pyrrolidine-2-carboxamide Openeye Name: N-[1-[2-[2-(2-amino-2-oxo-1-phenyl-ethoxy)ethylamino]-2-oxo-acetyl]butyl]-4-benzyloxy-1-[2-cyclohexyl-2-[[2-(methanesulfonamido)-4-methyl-pentanoyl]amino]acetyl]pyrrolidine-2-carboxamide CAS Name: N-[1-[2-(2-amino-2-oxo-1-phenylethoxy)ethylamino]-1,2-dioxohexan-3-yl]-1-[2-cyclohexyl-2-[[2-(methanesulfonamido)-4-methyl-1-oxopentyl]amino]-1-oxoethyl]-4-phenylmethoxy-2-pyrrolidinecarboxamide IUPAC Name: N-[1-[2-(2-amino-2-oxo-1-phenylethoxy)ethylamino]-1,2-dioxohexan-3-yl]-1-[2-cyclohexyl-2-[[2-(methanesulfonamido)-4-methylpentanoyl]amino]acetyl]-4-phenylmethoxypyrrolidine-2-carboxamide Traditional Name: N-[1-[2-[2-(2-amino-2-keto-1-phenyl-ethoxy)ethylamino]-2-keto-acetyl]butyl]-4-benzoxy-1-[2-cyclohexyl-2-[[2-(methanesulfonamido)-4-methyl-pentanoyl]amino]acetyl]pyrrolidine-2-carboxamide Formula: C43H62N6O10S MolecularWeight: 855.05158

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C(=O)NCCOC(C1=CC=CC=C1)C(=O)N)NC(=O)C2CC(CN2C(=O)C(C3CCCCC3)NC(=O)C(CC(C)C)NS(=O)(=O)C)OCC4=CC=CC=C4

Isomeric SMILES

CCCC(C(=O)C(=O)NCCOC(C1=CC=CC=C1)C(=O)N)NC(=O)C2CC(CN2C(=O)C(C3CCCCC3)NC(=O)C(CC(C)C)NS(=O)(=O)C)OCC4=CC=CC=C4

InChI

InChI=1S/C43H62N6O10S/c1-5-15-33(37(50)42(54)45-22-23-58-38(39(44)51)31-20-13-8-14-21-31)46-41(53)35-25-32(59-27-29-16-9-6-10-17-29)26-49(35)43(55)36(30-18-11-7-12-19-30)47-40(52)34(24-28(2)3)48-60(4,56)57/h6,8-10,13-14,16-17,20-21,28,30,32-36,38,48H,5,7,11-12,15,18-19,22-27H2,1-4H3,(H2,44,51)(H,45,54)(H,46,53)(H,47,52)