3-methyl-N-[1-[5-methyl-1-(2-methylphenyl)pyrazol-4-yl]ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-methyl-N-[1-[5-methyl-1-(2-methylphenyl)pyrazol-4-yl]ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-N-[1-[5-methyl-1-(o-tolyl)pyrazol-4-yl]ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-N-[1-[5-methyl-1-(2-methylphenyl)-4-pyrazolyl]ethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-[1-[5-methyl-1-(2-methylphenyl)pyrazol-4-yl]ethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[1-[5-methyl-1-(o-tolyl)pyrazol-4-yl]ethyl]phthalazine-1-carboxamide Formula: C23H23N5O2 MolecularWeight: 401.46102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C=N2)C(C)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C=N2)C(C)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C)C

InChI

InChI=1S/C23H23N5O2/c1-14-9-5-8-12-20(14)28-16(3)19(13-24-28)15(2)25-22(29)21-17-10-6-7-11-18(17)23(30)27(4)26-21/h5-13,15H,1-4H3,(H,25,29)