N-[4-[(3-cyanophenyl)carbamoyl]phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-[(3-cyanophenyl)carbamoyl]phenyl]adamantane-1-carboxamide Openeye Name: N-[4-[(3-cyanophenyl)carbamoyl]phenyl]adamantane-1-carboxamide CAS Name: N-[4-[(3-cyanoanilino)-oxomethyl]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-[(3-cyanophenyl)carbamoyl]phenyl]adamantane-1-carboxamide Traditional Name: N-[4-[(3-cyanophenyl)carbamoyl]phenyl]adamantane-1-carboxamide Formula: C25H25N3O2 MolecularWeight: 399.4849

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=CC=CC(=C5)C#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=CC=CC(=C5)C#N

InChI

InChI=1S/C25H25N3O2/c26-15-16-2-1-3-22(11-16)27-23(29)20-4-6-21(7-5-20)28-24(30)25-12-17-8-18(13-25)10-19(9-17)14-25/h1-7,11,17-19H,8-10,12-14H2,(H,27,29)(H,28,30)