N-(2-methyl-1,3-benzothiazol-5-yl)-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-5-yl)-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide Openeye Name: N-(2-methyl-1,3-benzothiazol-5-yl)-2-(4-oxo-3H-phthalazin-1-yl)acetamide CAS Name: N-(2-methyl-1,3-benzothiazol-5-yl)-2-(4-oxo-3H-phthalazin-1-yl)acetamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-5-yl)-2-(4-oxo-3H-phthalazin-1-yl)acetamide Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)-N-(2-methyl-1,3-benzothiazol-5-yl)acetamide Formula: C18H14N4O2S MolecularWeight: 350.39436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)NC(=O)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)NC(=O)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C18H14N4O2S/c1-10-19-15-8-11(6-7-16(15)25-10)20-17(23)9-14-12-4-2-3-5-13(12)18(24)22-21-14/h2-8H,9H2,1H3,(H,20,23)(H,22,24)