3-(phenylmethyl)-2-propan-2-ylsulfanyl-5,6-dihydroimidazo[4,5-d]pyridazine-4,7-dione

Systemtic Name: 3-(phenylmethyl)-2-propan-2-ylsulfanyl-5,6-dihydroimidazo[4,5-d]pyridazine-4,7-dione Openeye Name: 3-benzyl-2-isopropylsulfanyl-5,6-dihydroimidazo[4,5-d]pyridazine-4,7-dione CAS Name: 3-(phenylmethyl)-2-(propan-2-ylthio)-5,6-dihydroimidazo[4,5-d]pyridazine-4,7-dione IUPAC Name: 3-benzyl-2-propan-2-ylsulfanyl-5,6-dihydroimidazo[4,5-d]pyridazine-4,7-dione Traditional Name: 3-benzyl-2-(isopropylthio)-5,6-dihydroimidazo[4,5-d]pyridazine-4,7-quinone Formula: C15H16N4O2S MolecularWeight: 316.37814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC2=C(N1CC3=CC=CC=C3)C(=O)NNC2=O

Isomeric SMILES

CC(C)SC1=NC2=C(N1CC3=CC=CC=C3)C(=O)NNC2=O

InChI

InChI=1S/C15H16N4O2S/c1-9(2)22-15-16-11-12(14(21)18-17-13(11)20)19(15)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,17,20)(H,18,21)