N5-[2-(4-fluorophenyl)ethyl]-2-[10-[5-[2-(4-fluorophenyl)ethylcarbamoyl]-6-[(4-methylphenyl)methylcarbamoyl]-1,3-dihydroisoindol-2-yl]-10-oxidanylidene-decanoyl]-N6-[(4-methylphenyl)methyl]-1,3-dihydroisoindole-5,6-dicarboxamide

Systemtic Name: N5-[2-(4-fluorophenyl)ethyl]-2-[10-[5-[2-(4-fluorophenyl)ethylcarbamoyl]-6-[(4-methylphenyl)methylcarbamoyl]-1,3-dihydroisoindol-2-yl]-10-oxidanylidene-decanoyl]-N6-[(4-methylphenyl)methyl]-1,3-dihydroisoindole-5,6-dicarboxamide Openeye Name: N6-[2-(4-fluorophenyl)ethyl]-2-[10-[5-[2-(4-fluorophenyl)ethylcarbamoyl]-6-(p-tolylmethylcarbamoyl)isoindolin-2-yl]-10-oxo-decanoyl]-N5-(p-tolylmethyl)isoindoline-5,6-dicarboxamide CAS Name: N5-[2-(4-fluorophenyl)ethyl]-2-[10-[5-[[2-(4-fluorophenyl)ethylamino]-oxomethyl]-6-[[(4-methylphenyl)methylamino]-oxomethyl]-1,3-dihydroisoindol-2-yl]-1,10-dioxodecyl]-N6-[(4-methylphenyl)methyl]-1,3-dihydroisoindole-5,6-dicarboxamide IUPAC Name: 5-N-[2-(4-fluorophenyl)ethyl]-2-[10-[5-[2-(4-fluorophenyl)ethylcarbamoyl]-6-[(4-methylphenyl)methylcarbamoyl]-1,3-dihydroisoindol-2-yl]-10-oxodecanoyl]-6-N-[(4-methylphenyl)methyl]-1,3-dihydroisoindole-5,6-dicarboxamide Traditional Name: N'-[2-(4-fluorophenyl)ethyl]-2-[10-[5-[2-(4-fluorophenyl)ethylcarbamoyl]-6-[(4-methylbenzyl)carbamoyl]isoindolin-2-yl]-10-keto-decanoyl]-N-(4-methylbenzyl)isoindoline-5,6-dicarboxamide Formula: C62H66F2N6O6 MolecularWeight: 1029.220846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CC3=C(CN(C3)C(=O)CCCCCCCCC(=O)N4CC5=C(C4)C=C(C(=C5)C(=O)NCCC6=CC=C(C=C6)F)C(=O)NCC7=CC=C(C=C7)C)C=C2C(=O)NCCC8=CC=C(C=C8)F

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CC3=C(CN(C3)C(=O)CCCCCCCCC(=O)N4CC5=C(C4)C=C(C(=C5)C(=O)NCCC6=CC=C(C=C6)F)C(=O)NCC7=CC=C(C=C7)C)C=C2C(=O)NCCC8=CC=C(C=C8)F

InChI

InChI=1S/C62H66F2N6O6/c1-41-11-15-45(16-12-41)35-67-61(75)55-33-49-39-69(37-47(49)31-53(55)59(73)65-29-27-43-19-23-51(63)24-20-43)57(71)9-7-5-3-4-6-8-10-58(72)70-38-48-32-54(60(74)66-30-28-44-21-25-52(64)26-22-44)56(34-50(48)40-70)62(76)68-36-46-17-13-42(2)14-18-46/h11-26,31-34H,3-10,27-30,35-40H2,1-2H3,(H,65,73)(H,66,74)(H,67,75)(H,68,76)