3-(4-chlorophenyl)-4-oxidanylidene-N-(pyridin-4-ylmethyl)phthalazine-1-carboxamide

Systemtic Name: 3-(4-chlorophenyl)-4-oxidanylidene-N-(pyridin-4-ylmethyl)phthalazine-1-carboxamide Openeye Name: 3-(4-chlorophenyl)-4-oxo-N-(4-pyridylmethyl)phthalazine-1-carboxamide CAS Name: 3-(4-chlorophenyl)-4-oxo-N-(pyridin-4-ylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-(4-chlorophenyl)-4-oxo-N-(pyridin-4-ylmethyl)phthalazine-1-carboxamide Traditional Name: 3-(4-chlorophenyl)-4-keto-N-(4-pyridylmethyl)phthalazine-1-carboxamide Formula: C21H15ClN4O2 MolecularWeight: 390.8224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)C3=CC=C(C=C3)Cl)C(=O)NCC4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)C3=CC=C(C=C3)Cl)C(=O)NCC4=CC=NC=C4

InChI

InChI=1S/C21H15ClN4O2/c22-15-5-7-16(8-6-15)26-21(28)18-4-2-1-3-17(18)19(25-26)20(27)24-13-14-9-11-23-12-10-14/h1-12H,13H2,(H,24,27)