N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[1-oxo-4-(2-thienyl)phthalazin-2-yl]acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(1-oxo-4-thiophen-2-yl-2-phthalazinyl)acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(1-oxo-4-thiophen-2-ylphthalazin-2-yl)acetamide Traditional Name: N-homoveratryl-2-[1-keto-4-(2-thienyl)phthalazin-2-yl]acetamide Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23N3O4S/c1-30-19-10-9-16(14-20(19)31-2)11-12-25-22(28)15-27-24(29)18-7-4-3-6-17(18)23(26-27)21-8-5-13-32-21/h3-10,13-14H,11-12,15H2,1-2H3,(H,25,28)