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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

InChI

InChI=1S/C23H26N4O3/c1-14(2)13-27-23(30)18-11-6-5-10-17(18)21(26-27)22(29)24-12-19(28)25-20-15(3)8-7-9-16(20)4/h5-11,14H,12-13H2,1-4H3,(H,24,29)(H,25,28)