2-(4-oxidanylidene-3H-phthalazin-1-yl)-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-(4-oxidanylidene-3H-phthalazin-1-yl)-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-[[4-(1-pyrazolylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)-N-[4-(pyrazol-1-ylmethyl)benzyl]acetamide Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)NCC3=CC=C(C=C3)CN4C=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)NCC3=CC=C(C=C3)CN4C=CC=N4

InChI

InChI=1S/C21H19N5O2/c27-20(12-19-17-4-1-2-5-18(17)21(28)25-24-19)22-13-15-6-8-16(9-7-15)14-26-11-3-10-23-26/h1-11H,12-14H2,(H,22,27)(H,25,28)