N-[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]-5-bromanyl-thiophene-3-carboxamide

Systemtic Name: N-[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]-5-bromanyl-thiophene-3-carboxamide Openeye Name: 5-bromo-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)thiophene-3-carboxamide CAS Name: 5-bromo-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-3-thiophenecarboxamide IUPAC Name: 5-bromo-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)thiophene-3-carboxamide Traditional Name: 5-bromo-N-(1,4-diketo-2,3-dihydrophthalazin-5-yl)thiophene-3-carboxamide Formula: C13H8BrN3O3S MolecularWeight: 366.18992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NC(=O)C3=CSC(=C3)Br)C(=O)NNC2=O

Isomeric SMILES

C1=CC2=C(C(=C1)NC(=O)C3=CSC(=C3)Br)C(=O)NNC2=O

InChI

InChI=1S/C13H8BrN3O3S/c14-9-4-6(5-21-9)11(18)15-8-3-1-2-7-10(8)13(20)17-16-12(7)19/h1-5H,(H,15,18)(H,16,19)(H,17,20)