N'-[2-[8-bromanyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-9-yl]ethanoyl]thiophene-2-carbohydrazide

Systemtic Name: N'-[2-[8-bromanyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-9-yl]ethanoyl]thiophene-2-carbohydrazide Openeye Name: N'-[2-(8-bromo-1,3-dimethyl-2,6-dioxo-purin-9-yl)acetyl]thiophene-2-carbohydrazide CAS Name: N'-[2-(8-bromo-1,3-dimethyl-2,6-dioxo-9-purinyl)-1-oxoethyl]-2-thiophenecarbohydrazide IUPAC Name: N'-[2-(8-bromo-1,3-dimethyl-2,6-dioxopurin-9-yl)acetyl]thiophene-2-carbohydrazide Traditional Name: N'-[2-(8-bromo-2,6-diketo-1,3-dimethyl-purin-9-yl)acetyl]thiophene-2-carbohydrazide Formula: C14H13BrN6O4S MolecularWeight: 441.25982

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N=C(N2CC(=O)NNC(=O)C3=CC=CS3)Br

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N=C(N2CC(=O)NNC(=O)C3=CC=CS3)Br

InChI

InChI=1S/C14H13BrN6O4S/c1-19-11-9(12(24)20(2)14(19)25)16-13(15)21(11)6-8(22)17-18-10(23)7-4-3-5-26-7/h3-5H,6H2,1-2H3,(H,17,22)(H,18,23)