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

Systemtic Name: N-(1-adamantylmethyl)-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(1-adamantylmethyl)-3-isobutyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(1-adamantylmethyl)-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(1-adamantylmethyl)-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(1-adamantylmethyl)-3-isobutyl-4-keto-phthalazine-1-carboxamide Formula: C24H31N3O2 MolecularWeight: 393.52184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H31N3O2/c1-15(2)13-27-23(29)20-6-4-3-5-19(20)21(26-27)22(28)25-14-24-10-16-7-17(11-24)9-18(8-16)12-24/h3-6,15-18H,7-14H2,1-2H3,(H,25,28)