N-(1-adamantyl)-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(1-adamantyl)-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(1-adamantyl)-3-isobutyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(1-adamantyl)-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(1-adamantyl)-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(1-adamantyl)-3-isobutyl-4-keto-phthalazine-1-carboxamide Formula: C23H29N3O2 MolecularWeight: 379.49526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H29N3O2/c1-14(2)13-26-22(28)19-6-4-3-5-18(19)20(25-26)21(27)24-23-10-15-7-16(11-23)9-17(8-15)12-23/h3-6,14-17H,7-13H2,1-2H3,(H,24,27)