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

Systemtic Name: 3-butyl-4-oxidanylidene-N-(4-phenyl-1,3-thiazol-2-yl)phthalazine-1-carboxamide Openeye Name: 3-butyl-4-oxo-N-(4-phenylthiazol-2-yl)phthalazine-1-carboxamide CAS Name: 3-butyl-4-oxo-N-(4-phenyl-2-thiazolyl)-1-phthalazinecarboxamide IUPAC Name: 3-butyl-4-oxo-N-(4-phenyl-1,3-thiazol-2-yl)phthalazine-1-carboxamide Traditional Name: 3-butyl-4-keto-N-(4-phenylthiazol-2-yl)phthalazine-1-carboxamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4O2S/c1-2-3-13-26-21(28)17-12-8-7-11-16(17)19(25-26)20(27)24-22-23-18(14-29-22)15-9-5-4-6-10-15/h4-12,14H,2-3,13H2,1H3,(H,23,24,27)