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

Systemtic Name: N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-[(4-chlorophenyl)methyl]-3-pyrazolyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[2-(4-chlorobenzyl)pyrazol-3-yl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C20H16ClN5O2 MolecularWeight: 393.82634

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=NN3CC4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=NN3CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H16ClN5O2/c1-25-20(28)16-5-3-2-4-15(16)18(24-25)19(27)23-17-10-11-22-26(17)12-13-6-8-14(21)9-7-13/h2-11H,12H2,1H3,(H,23,27)