1,3-dimethyl-7-(3-methylsulfonylphenyl)-5-phenyl-pyrazolo[4,3-d]pyrimidine

Systemtic Name: 1,3-dimethyl-7-(3-methylsulfonylphenyl)-5-phenyl-pyrazolo[4,3-d]pyrimidine Openeye Name: 1,3-dimethyl-7-(3-methylsulfonylphenyl)-5-phenyl-pyrazolo[4,3-d]pyrimidine CAS Name: 1,3-dimethyl-7-(3-methylsulfonylphenyl)-5-phenylpyrazolo[4,3-d]pyrimidine IUPAC Name: 1,3-dimethyl-7-(3-methylsulfonylphenyl)-5-phenylpyrazolo[4,3-d]pyrimidine Traditional Name: 7-(3-mesylphenyl)-1,3-dimethyl-5-phenyl-pyrazolo[4,3-d]pyrimidine Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N=C(N=C2C3=CC(=CC=C3)S(=O)(=O)C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=NN(C2=C1N=C(N=C2C3=CC(=CC=C3)S(=O)(=O)C)C4=CC=CC=C4)C

InChI

InChI=1S/C20H18N4O2S/c1-13-17-19(24(2)23-13)18(15-10-7-11-16(12-15)27(3,25)26)22-20(21-17)14-8-5-4-6-9-14/h4-12H,1-3H3