N-[1-(4-cyanophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-N-(pyridin-3-ylmethyl)adamantane-1-carboxamide

Systemtic Name: N-[1-(4-cyanophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-N-(pyridin-3-ylmethyl)adamantane-1-carboxamide Openeye Name: N-[1-(4-cyanophenyl)-2,5-dioxo-pyrrolidin-3-yl]-N-(3-pyridylmethyl)adamantane-1-carboxamide CAS Name: N-[1-(4-cyanophenyl)-2,5-dioxo-3-pyrrolidinyl]-N-(3-pyridinylmethyl)-1-adamantanecarboxamide IUPAC Name: N-[1-(4-cyanophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(pyridin-3-ylmethyl)adamantane-1-carboxamide Traditional Name: N-[1-(4-cyanophenyl)-2,5-diketo-pyrrolidin-3-yl]-N-(3-pyridylmethyl)adamantane-1-carboxamide Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)N(CC4=CN=CC=C4)C5CC(=O)N(C5=O)C6=CC=C(C=C6)C#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)N(CC4=CN=CC=C4)C5CC(=O)N(C5=O)C6=CC=C(C=C6)C#N

InChI

InChI=1S/C28H28N4O3/c29-15-18-3-5-23(6-4-18)32-25(33)11-24(26(32)34)31(17-19-2-1-7-30-16-19)27(35)28-12-20-8-21(13-28)10-22(9-20)14-28/h1-7,16,20-22,24H,8-14,17H2