N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C24H18N4O3S MolecularWeight: 442.48972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C24H18N4O3S/c1-2-31-16-12-13-19-20(14-16)32-24(25-19)26-22(29)21-17-10-6-7-11-18(17)23(30)28(27-21)15-8-4-3-5-9-15/h3-14H,2H2,1H3,(H,25,26,29)