N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide

Systemtic Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide Openeye Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-2-(4-oxo-3H-phthalazin-1-yl)acetamide CAS Name: N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide IUPAC Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-2-(4-oxo-3H-phthalazin-1-yl)acetamide Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)-N-(2-morpholino-1,3-benzothiazol-6-yl)acetamide Formula: C21H19N5O3S MolecularWeight: 421.47226

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)CC4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)CC4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C21H19N5O3S/c27-19(12-17-14-3-1-2-4-15(14)20(28)25-24-17)22-13-5-6-16-18(11-13)30-21(23-16)26-7-9-29-10-8-26/h1-6,11H,7-10,12H2,(H,22,27)(H,25,28)