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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C22H14N4O2S MolecularWeight: 398.43716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H14N4O2S/c27-20(24-22-23-17-12-6-7-13-18(17)29-22)19-15-10-4-5-11-16(15)21(28)26(25-19)14-8-2-1-3-9-14/h1-13H,(H,23,24,27)