N-[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-2-(1-methylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-2-[(1-methyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-2-(1-methylimidazol-2-yl)sulfanylacetamide Traditional Name: N-(1,4-diketo-2,3-dihydrophthalazin-5-yl)-2-[(1-methylimidazol-2-yl)thio]acetamide Formula: C14H13N5O3S MolecularWeight: 331.34972

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=CC=CC3=C2C(=O)NNC3=O

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=CC=CC3=C2C(=O)NNC3=O

InChI

InChI=1S/C14H13N5O3S/c1-19-6-5-15-14(19)23-7-10(20)16-9-4-2-3-8-11(9)13(22)18-17-12(8)21/h2-6H,7H2,1H3,(H,16,20)(H,17,21)(H,18,22)