3-butyl-N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-butyl-N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-butyl-N-[2-(2,6-dimethylanilino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-butyl-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-butyl-N-[2-(2,6-dimethylanilino)-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC(=O)NC3=C(C=CC=C3C)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC(=O)NC3=C(C=CC=C3C)C

InChI

InChI=1S/C23H26N4O3/c1-4-5-13-27-23(30)18-12-7-6-11-17(18)21(26-27)22(29)24-14-19(28)25-20-15(2)9-8-10-16(20)3/h6-12H,4-5,13-14H2,1-3H3,(H,24,29)(H,25,28)