2-(4-methyl-1-oxidanylidene-phthalazin-2-yl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]ethanamide

Systemtic Name: 2-(4-methyl-1-oxidanylidene-phthalazin-2-yl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]ethanamide Openeye Name: 2-(4-methyl-1-oxo-phthalazin-2-yl)-N-[3-[2-(2-thienyl)ethynyl]phenyl]acetamide CAS Name: 2-(4-methyl-1-oxo-2-phthalazinyl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]acetamide IUPAC Name: 2-(4-methyl-1-oxophthalazin-2-yl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]acetamide Traditional Name: 2-(1-keto-4-methyl-phthalazin-2-yl)-N-[3-[2-(2-thienyl)ethynyl]phenyl]acetamide Formula: C23H17N3O2S MolecularWeight: 399.46498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4

InChI

InChI=1S/C23H17N3O2S/c1-16-20-9-2-3-10-21(20)23(28)26(25-16)15-22(27)24-18-7-4-6-17(14-18)11-12-19-8-5-13-29-19/h2-10,13-14H,15H2,1H3,(H,24,27)