4-oxidanylidene-N-(5-propyl-1,3,4-thiadiazol-2-yl)-3H-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-(5-propyl-1,3,4-thiadiazol-2-yl)-3H-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)-3H-phthalazine-1-carboxamide CAS Name: 4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)-3H-phthalazine-1-carboxamide IUPAC Name: 4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-(5-propyl-1,3,4-thiadiazol-2-yl)-3H-phthalazine-1-carboxamide Formula: C14H13N5O2S MolecularWeight: 315.35032

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C14H13N5O2S/c1-2-5-10-16-19-14(22-10)15-13(21)11-8-6-3-4-7-9(8)12(20)18-17-11/h3-4,6-7H,2,5H2,1H3,(H,18,20)(H,15,19,21)