4-oxidanylidene-3-pentyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-pentyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)phthalazine-1-carboxamide Openeye Name: 4-oxo-3-pentyl-N-[4-(2-thienyl)thiazol-2-yl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-pentyl-N-(4-thiophen-2-yl-2-thiazolyl)-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-pentyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)phthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-[4-(2-thienyl)thiazol-2-yl]phthalazine-1-carboxamide Formula: C21H20N4O2S2 MolecularWeight: 424.5391

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)C4=CC=CS4

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)C4=CC=CS4

InChI

InChI=1S/C21H20N4O2S2/c1-2-3-6-11-25-20(27)15-9-5-4-8-14(15)18(24-25)19(26)23-21-22-16(13-29-21)17-10-7-12-28-17/h4-5,7-10,12-13H,2-3,6,11H2,1H3,(H,22,23,26)