N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazin-2-yl]ethanamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazin-2-yl]ethanamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[1-oxo-4-(4-pyridylmethyl)phthalazin-2-yl]acetamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[1-oxo-4-(pyridin-4-ylmethyl)-2-phthalazinyl]acetamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[1-oxo-4-(pyridin-4-ylmethyl)phthalazin-2-yl]acetamide Traditional Name: 2-[1-keto-4-(4-pyridylmethyl)phthalazin-2-yl]-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide Formula: C24H19N5O3S MolecularWeight: 457.50436

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3C(=O)C4=CC=CC=C4C(=N3)CC5=CC=NC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3C(=O)C4=CC=CC=C4C(=N3)CC5=CC=NC=C5

InChI

InChI=1S/C24H19N5O3S/c1-32-16-6-7-19-21(13-16)33-24(26-19)27-22(30)14-29-23(31)18-5-3-2-4-17(18)20(28-29)12-15-8-10-25-11-9-15/h2-11,13H,12,14H2,1H3,(H,26,27,30)