3-methyl-4-oxidanylidene-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-[2-(2-thienylmethyl)pyrazol-3-yl]phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-[2-(thiophen-2-ylmethyl)-3-pyrazolyl]-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]phthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[2-(2-thenyl)pyrazol-3-yl]phthalazine-1-carboxamide Formula: C18H15N5O2S MolecularWeight: 365.409

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=NN3CC4=CC=CS4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=NN3CC4=CC=CS4

InChI

InChI=1S/C18H15N5O2S/c1-22-18(25)14-7-3-2-6-13(14)16(21-22)17(24)20-15-8-9-19-23(15)11-12-5-4-10-26-12/h2-10H,11H2,1H3,(H,20,24)