4-oxidanylidene-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3H-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3H-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3H-phthalazine-1-carboxamide CAS Name: 4-oxo-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3H-phthalazine-1-carboxamide IUPAC Name: 4-oxo-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3H-phthalazine-1-carboxamide Formula: C16H14N4O2S MolecularWeight: 326.37296

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C16H14N4O2S/c21-14-10-6-2-1-5-9(10)13(19-20-14)15(22)18-16-17-11-7-3-4-8-12(11)23-16/h1-2,5-6H,3-4,7-8H2,(H,20,21)(H,17,18,22)