3-(phenylmethyl)-2-sulfanylidene-5,6-dihydro-1H-imidazo[4,5-d]pyridazine-4,7-dione

Systemtic Name: 3-(phenylmethyl)-2-sulfanylidene-5,6-dihydro-1H-imidazo[4,5-d]pyridazine-4,7-dione Openeye Name: 3-benzyl-2-thioxo-5,6-dihydro-1H-imidazo[4,5-d]pyridazine-4,7-dione CAS Name: 3-(phenylmethyl)-2-sulfanylidene-5,6-dihydro-1H-imidazo[4,5-d]pyridazine-4,7-dione IUPAC Name: 3-benzyl-2-sulfanylidene-5,6-dihydro-1H-imidazo[4,5-d]pyridazine-4,7-dione Traditional Name: 3-benzyl-2-thioxo-5,6-dihydro-1H-imidazo[4,5-d]pyridazine-4,7-quinone Formula: C12H10N4O2S MolecularWeight: 274.2984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C(=O)NNC3=O)NC2=S

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C(=O)NNC3=O)NC2=S

InChI

InChI=1S/C12H10N4O2S/c17-10-8-9(11(18)15-14-10)16(12(19)13-8)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,13,19)(H,14,17)(H,15,18)