methyl 2-[[1-azanyl-3-(cyclohexylamino)-3-oxidanylidene-1-phenyl-propan-2-yl]-(2,2-diphenylethanoyl)amino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[1-azanyl-3-(cyclohexylamino)-3-oxidanylidene-1-phenyl-propan-2-yl]-(2,2-diphenylethanoyl)amino]-3-phenyl-propanoate Openeye Name: methyl 2-[[1-[amino(phenyl)methyl]-2-(cyclohexylamino)-2-oxo-ethyl]-(2,2-diphenylacetyl)amino]-3-phenyl-propanoate CAS Name: 2-[[1-amino-3-(cyclohexylamino)-3-oxo-1-phenylpropan-2-yl]-(1-oxo-2,2-diphenylethyl)amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[1-amino-3-(cyclohexylamino)-3-oxo-1-phenylpropan-2-yl]-(2,2-diphenylacetyl)amino]-3-phenylpropanoate Traditional Name: 2-[[1-[amino(phenyl)methyl]-2-(cyclohexylamino)-2-keto-ethyl]-(2,2-diphenylacetyl)amino]-3-phenyl-propionic acid methyl ester Formula: C39H43N3O4 MolecularWeight: 617.77642

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)N(C(C(C2=CC=CC=C2)N)C(=O)NC3CCCCC3)C(=O)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)N(C(C(C2=CC=CC=C2)N)C(=O)NC3CCCCC3)C(=O)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C39H43N3O4/c1-46-39(45)33(27-28-17-7-2-8-18-28)42(38(44)34(29-19-9-3-10-20-29)30-21-11-4-12-22-30)36(35(40)31-23-13-5-14-24-31)37(43)41-32-25-15-6-16-26-32/h2-5,7-14,17-24,32-36H,6,15-16,25-27,40H2,1H3,(H,41,43)