N-(6-methoxy-1,3-benzothiazol-2-yl)-3-(3-methoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-3-(3-methoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-3-(3-methoxyphenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-3-(3-methoxyphenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-3-(3-methoxyphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-(3-methoxyphenyl)phthalazine-1-carboxamide Formula: C24H18N4O4S MolecularWeight: 458.48912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC(=CC=C5)OC

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC(=CC=C5)OC

InChI

InChI=1S/C24H18N4O4S/c1-31-15-7-5-6-14(12-15)28-23(30)18-9-4-3-8-17(18)21(27-28)22(29)26-24-25-19-11-10-16(32-2)13-20(19)33-24/h3-13H,1-2H3,(H,25,26,29)