N-[4-(1-adamantyl)phenyl]-6-oxidanylidene-1H-pyridazine-3-carboxamide

Systemtic Name: N-[4-(1-adamantyl)phenyl]-6-oxidanylidene-1H-pyridazine-3-carboxamide Openeye Name: N-[4-(1-adamantyl)phenyl]-6-oxo-1H-pyridazine-3-carboxamide CAS Name: N-[4-(1-adamantyl)phenyl]-6-oxo-1H-pyridazine-3-carboxamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-6-oxo-1H-pyridazine-3-carboxamide Traditional Name: N-[4-(1-adamantyl)phenyl]-6-keto-1H-pyridazine-3-carboxamide Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)C5=NNC(=O)C=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)C5=NNC(=O)C=C5

InChI

InChI=1S/C21H23N3O2/c25-19-6-5-18(23-24-19)20(26)22-17-3-1-16(2-4-17)21-10-13-7-14(11-21)9-15(8-13)12-21/h1-6,13-15H,7-12H2,(H,22,26)(H,24,25)