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

Systemtic Name: 4-oxidanylidene-3-propyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)phthalazine-1-carboxamide Openeye Name: 4-oxo-3-propyl-N-[4-(3-pyridyl)thiazol-2-yl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-propyl-N-[4-(3-pyridinyl)-2-thiazolyl]-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-propyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)phthalazine-1-carboxamide Traditional Name: 4-keto-3-propyl-N-[4-(3-pyridyl)thiazol-2-yl]phthalazine-1-carboxamide Formula: C20H17N5O2S MolecularWeight: 391.44628

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)C4=CN=CC=C4

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)C4=CN=CC=C4

InChI

InChI=1S/C20H17N5O2S/c1-2-10-25-19(27)15-8-4-3-7-14(15)17(24-25)18(26)23-20-22-16(12-28-20)13-6-5-9-21-11-13/h3-9,11-12H,2,10H2,1H3,(H,22,23,26)