N-[(2,4-dichlorophenyl)methyl]-2-(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)ethanamide

Systemtic Name: N-[(2,4-dichlorophenyl)methyl]-2-(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)ethanamide Openeye Name: N-[(2,4-dichlorophenyl)methyl]-2-[1-oxo-4-(2-thienyl)phthalazin-2-yl]acetamide CAS Name: N-[(2,4-dichlorophenyl)methyl]-2-(1-oxo-4-thiophen-2-yl-2-phthalazinyl)acetamide IUPAC Name: N-[(2,4-dichlorophenyl)methyl]-2-(1-oxo-4-thiophen-2-ylphthalazin-2-yl)acetamide Traditional Name: N-(2,4-dichlorobenzyl)-2-[1-keto-4-(2-thienyl)phthalazin-2-yl]acetamide Formula: C21H15Cl2N3O2S MolecularWeight: 444.3337

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NCC3=C(C=C(C=C3)Cl)Cl)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NCC3=C(C=C(C=C3)Cl)Cl)C4=CC=CS4

InChI

InChI=1S/C21H15Cl2N3O2S/c22-14-8-7-13(17(23)10-14)11-24-19(27)12-26-21(28)16-5-2-1-4-15(16)20(25-26)18-6-3-9-29-18/h1-10H,11-12H2,(H,24,27)