3-methyl-4-oxidanylidene-N-(6-phenoxy-1,3-benzothiazol-2-yl)phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-(6-phenoxy-1,3-benzothiazol-2-yl)phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-(6-phenoxy-1,3-benzothiazol-2-yl)phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-(6-phenoxy-1,3-benzothiazol-2-yl)-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-(6-phenoxy-1,3-benzothiazol-2-yl)phthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-(6-phenoxy-1,3-benzothiazol-2-yl)phthalazine-1-carboxamide Formula: C23H16N4O3S MolecularWeight: 428.46314

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC4=C(S3)C=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC4=C(S3)C=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C23H16N4O3S/c1-27-22(29)17-10-6-5-9-16(17)20(26-27)21(28)25-23-24-18-12-11-15(13-19(18)31-23)30-14-7-3-2-4-8-14/h2-13H,1H3,(H,24,25,28)