N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-yl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C20H18N6O4 MolecularWeight: 406.39472

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NNC(=N3)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NNC(=N3)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C20H18N6O4/c1-26-19(28)13-7-5-4-6-12(13)16(25-26)18(27)22-20-21-17(23-24-20)11-8-9-14(29-2)15(10-11)30-3/h4-10H,1-3H3,(H2,21,22,23,24,27)