N-[1-[[1-[(1-cyclohexyl-5-ethyl-6-methyl-3-oxidanyl-heptan-2-yl)amino]-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: N-[1-[[1-[(1-cyclohexyl-5-ethyl-6-methyl-3-oxidanyl-heptan-2-yl)amino]-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]pyrrolidine-2-carboxamide Openeye Name: N-[1-benzyl-2-[[2-[[1-(cyclohexylmethyl)-4-ethyl-2-hydroxy-5-methyl-hexyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]amino]-2-oxo-ethyl]pyrrolidine-2-carboxamide CAS Name: N-[1-[[1-[(1-cyclohexyl-5-ethyl-3-hydroxy-6-methylheptan-2-yl)amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: N-[1-[[1-[(1-cyclohexyl-5-ethyl-3-hydroxy-6-methylheptan-2-yl)amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]pyrrolidine-2-carboxamide Traditional Name: N-[1-benzyl-2-[[2-[[1-(cyclohexylmethyl)-4-ethyl-2-hydroxy-5-methyl-hexyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-keto-ethyl]amino]-2-keto-ethyl]pyrrolidine-2-carboxamide Formula: C36H56N6O4 MolecularWeight: 636.86764

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C(CC1CCCCC1)NC(=O)C(CC2=CN=CN2)NC(=O)C(CC3=CC=CC=C3)NC(=O)C4CCCN4)O)C(C)C

Isomeric SMILES

CCC(CC(C(CC1CCCCC1)NC(=O)C(CC2=CN=CN2)NC(=O)C(CC3=CC=CC=C3)NC(=O)C4CCCN4)O)C(C)C

InChI

InChI=1S/C36H56N6O4/c1-4-27(24(2)3)20-33(43)30(18-25-12-7-5-8-13-25)40-36(46)32(21-28-22-37-23-39-28)42-35(45)31(19-26-14-9-6-10-15-26)41-34(44)29-16-11-17-38-29/h6,9-10,14-15,22-25,27,29-33,38,43H,4-5,7-8,11-13,16-21H2,1-3H3,(H,37,39)(H,40,46)(H,41,44)(H,42,45)