N-(3,5-dimethoxyphenyl)-2-(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)ethanamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-2-(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)ethanamide Openeye Name: N-(3,5-dimethoxyphenyl)-2-[1-oxo-4-(2-thienyl)phthalazin-2-yl]acetamide CAS Name: N-(3,5-dimethoxyphenyl)-2-(1-oxo-4-thiophen-2-yl-2-phthalazinyl)acetamide IUPAC Name: N-(3,5-dimethoxyphenyl)-2-(1-oxo-4-thiophen-2-ylphthalazin-2-yl)acetamide Traditional Name: N-(3,5-dimethoxyphenyl)-2-[1-keto-4-(2-thienyl)phthalazin-2-yl]acetamide Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4)OC

InChI

InChI=1S/C22H19N3O4S/c1-28-15-10-14(11-16(12-15)29-2)23-20(26)13-25-22(27)18-7-4-3-6-17(18)21(24-25)19-8-5-9-30-19/h3-12H,13H2,1-2H3,(H,23,26)