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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(2-methylpropyl)-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-isobutyl-2-(4-oxo-3H-phthalazin-1-yl)acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(2-methylpropyl)-2-(4-oxo-3H-phthalazin-1-yl)acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(2-methylpropyl)-2-(4-oxo-3H-phthalazin-1-yl)acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-isobutyl-2-(4-keto-3H-phthalazin-1-yl)acetamide Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C1=NC2=CC=CC=C2S1)C(=O)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CC(C)CN(C1=NC2=CC=CC=C2S1)C(=O)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H20N4O2S/c1-13(2)12-25(21-22-16-9-5-6-10-18(16)28-21)19(26)11-17-14-7-3-4-8-15(14)20(27)24-23-17/h3-10,13H,11-12H2,1-2H3,(H,24,27)