4-oxidanylidene-3-(phenylmethyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-(phenylmethyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-[4-(2-pyridyl)thiazol-2-yl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-(phenylmethyl)-N-[4-(2-pyridinyl)-2-thiazolyl]-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-4-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[4-(2-pyridyl)thiazol-2-yl]phthalazine-1-carboxamide Formula: C24H17N5O2S MolecularWeight: 439.48908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=NC(=CS4)C5=CC=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=NC(=CS4)C5=CC=CC=N5

InChI

InChI=1S/C24H17N5O2S/c30-22(27-24-26-20(15-32-24)19-12-6-7-13-25-19)21-17-10-4-5-11-18(17)23(31)29(28-21)14-16-8-2-1-3-9-16/h1-13,15H,14H2,(H,26,27,30)