N-[4-(tert-butylcarbamoyl)phenyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-[4-(tert-butylcarbamoyl)phenyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[4-(tert-butylcarbamoyl)phenyl]-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[4-[(tert-butylamino)-oxomethyl]phenyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[4-(tert-butylcarbamoyl)phenyl]-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-[4-(tert-butylcarbamoyl)phenyl]-4-keto-phthalazine-1-carboxamide Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)C(=O)NC(C)(C)C

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)C(=O)NC(C)(C)C

InChI

InChI=1S/C25H30N4O3/c1-5-6-9-16-29-24(32)20-11-8-7-10-19(20)21(28-29)23(31)26-18-14-12-17(13-15-18)22(30)27-25(2,3)4/h7-8,10-15H,5-6,9,16H2,1-4H3,(H,26,31)(H,27,30)