6-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-2-phenyl-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione

Systemtic Name: 6-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-2-phenyl-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione Openeye Name: 6-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-2-phenyl-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione CAS Name: 6-[[(4-methyl-2-pyrimidinyl)thio]methyl]-2-phenyl-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione IUPAC Name: 6-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-2-phenyl-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione Traditional Name: 6-[[(4-methylpyrimidin-2-yl)thio]methyl]-2-phenyl-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-quinone Formula: C18H15N5O2S MolecularWeight: 365.409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC2=CC(=O)C3=C(N2)NN(C3=O)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=NC=C1)SCC2=CC(=O)C3=C(N2)NN(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C18H15N5O2S/c1-11-7-8-19-18(20-11)26-10-12-9-14(24)15-16(21-12)22-23(17(15)25)13-5-3-2-4-6-13/h2-9H,10H2,1H3,(H2,21,22,24)