2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(5-pentyl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(5-pentyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)acetamide IUPAC Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-2-(1,4-diketo-3H-phthalazin-2-yl)acetamide Formula: C17H19N5O3S MolecularWeight: 373.42946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C17H19N5O3S/c1-2-3-4-9-14-19-20-17(26-14)18-13(23)10-22-16(25)12-8-6-5-7-11(12)15(24)21-22/h5-8H,2-4,9-10H2,1H3,(H,21,24)(H,18,20,23)