6-azanyl-5-[(6-azanyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)-(1,3-diphenylpyrazol-4-yl)methyl]-2-methylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-5-[(6-azanyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)-(1,3-diphenylpyrazol-4-yl)methyl]-2-methylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-amino-5-[(6-amino-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-(1,3-diphenylpyrazol-4-yl)methyl]-2-methylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-amino-5-[[6-amino-2-(methylthio)-4-oxo-1H-pyrimidin-5-yl]-(1,3-diphenyl-4-pyrazolyl)methyl]-2-(methylthio)-1H-pyrimidin-4-one IUPAC Name: 6-amino-5-[(6-amino-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-(1,3-diphenylpyrazol-4-yl)methyl]-2-methylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-amino-5-[[6-amino-4-keto-2-(methylthio)-1H-pyrimidin-5-yl]-(1,3-diphenylpyrazol-4-yl)methyl]-2-(methylthio)-1H-pyrimidin-4-one Formula: C26H24N8O2S2 MolecularWeight: 544.65116

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=O)C(=C(N1)N)C(C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=C(NC(=NC5=O)SC)N

Isomeric SMILES

CSC1=NC(=O)C(=C(N1)N)C(C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=C(NC(=NC5=O)SC)N

InChI

InChI=1S/C26H24N8O2S2/c1-37-25-29-21(27)18(23(35)31-25)17(19-22(28)30-26(38-2)32-24(19)36)16-13-34(15-11-7-4-8-12-15)33-20(16)14-9-5-3-6-10-14/h3-13,17H,1-2H3,(H3,27,29,31,35)(H3,28,30,32,36)