1-[5-(4-methylsulfanylphenyl)-4-oxidanylidene-6-phenyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl]urea

Systemtic Name: 1-[5-(4-methylsulfanylphenyl)-4-oxidanylidene-6-phenyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl]urea Openeye Name: [5-(4-methylsulfanylphenyl)-4-oxo-6-phenyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl]urea CAS Name: [5-[4-(methylthio)phenyl]-4-oxo-6-phenyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl]urea IUPAC Name: [5-(4-methylsulfanylphenyl)-4-oxo-6-phenyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl]urea Traditional Name: [4-keto-5-[4-(methylthio)phenyl]-6-phenyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl]urea Formula: C19H16N6O2S MolecularWeight: 392.43434

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2C(=NC3=C(C2=O)C(=NN3)NC(=O)N)C4=CC=CC=C4

Isomeric SMILES

CSC1=CC=C(C=C1)N2C(=NC3=C(C2=O)C(=NN3)NC(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C19H16N6O2S/c1-28-13-9-7-12(8-10-13)25-17(11-5-3-2-4-6-11)21-15-14(18(25)26)16(24-23-15)22-19(20)27/h2-10H,1H3,(H4,20,22,23,24,27)