4-chloranyl-3-methyl-1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-chloranyl-3-methyl-1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidine Openeye Name: 4-chloro-3-methyl-1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidine CAS Name: 4-chloro-3-methyl-1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 4-chloro-3-methyl-1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidine Traditional Name: 4-chloro-1-(4-mesylphenyl)-3-methyl-pyrazolo[3,4-d]pyrimidine Formula: C13H11ClN4O2S MolecularWeight: 322.77004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=NC=N2)Cl)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=NN(C2=C1C(=NC=N2)Cl)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C13H11ClN4O2S/c1-8-11-12(14)15-7-16-13(11)18(17-8)9-3-5-10(6-4-9)21(2,19)20/h3-7H,1-2H3