2-(4-methoxyphenyl)-6-(pyrimidin-2-ylsulfanylmethyl)-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione

Systemtic Name: 2-(4-methoxyphenyl)-6-(pyrimidin-2-ylsulfanylmethyl)-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione Openeye Name: 2-(4-methoxyphenyl)-6-(pyrimidin-2-ylsulfanylmethyl)-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione CAS Name: 2-(4-methoxyphenyl)-6-[(2-pyrimidinylthio)methyl]-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione IUPAC Name: 2-(4-methoxyphenyl)-6-(pyrimidin-2-ylsulfanylmethyl)-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione Traditional Name: 2-(4-methoxyphenyl)-6-[(2-pyrimidylthio)methyl]-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-quinone Formula: C18H15N5O3S MolecularWeight: 381.4084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=C(N2)NC(=CC3=O)CSC4=NC=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=C(N2)NC(=CC3=O)CSC4=NC=CC=N4

InChI

InChI=1S/C18H15N5O3S/c1-26-13-5-3-12(4-6-13)23-17(25)15-14(24)9-11(21-16(15)22-23)10-27-18-19-7-2-8-20-18/h2-9H,10H2,1H3,(H2,21,22,24)