N-methyl-4-oxidanylidene-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-3H-phthalazine-1-carboxamide

Systemtic Name: N-methyl-4-oxidanylidene-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-3H-phthalazine-1-carboxamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-methyl-4-oxo-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]-3H-phthalazine-1-carboxamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-4-keto-N-methyl-3H-phthalazine-1-carboxamide Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H19N5O2/c1-25(12-16-11-22-26(14-16)13-15-7-3-2-4-8-15)21(28)19-17-9-5-6-10-18(17)20(27)24-23-19/h2-11,14H,12-13H2,1H3,(H,24,27)