5-(4-fluorophenyl)-1,3-dimethyl-N-(4-methylsulfonylphenyl)pyrazolo[4,3-d]pyrimidin-7-amine

Systemtic Name: 5-(4-fluorophenyl)-1,3-dimethyl-N-(4-methylsulfonylphenyl)pyrazolo[4,3-d]pyrimidin-7-amine Openeye Name: 5-(4-fluorophenyl)-1,3-dimethyl-N-(4-methylsulfonylphenyl)pyrazolo[4,3-d]pyrimidin-7-amine CAS Name: 5-(4-fluorophenyl)-1,3-dimethyl-N-(4-methylsulfonylphenyl)-7-pyrazolo[4,3-d]pyrimidinamine IUPAC Name: 5-(4-fluorophenyl)-1,3-dimethyl-N-(4-methylsulfonylphenyl)pyrazolo[4,3-d]pyrimidin-7-amine Traditional Name: [5-(4-fluorophenyl)-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-7-yl]-(4-mesylphenyl)amine Formula: C20H18FN5O2S MolecularWeight: 411.452623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N=C(N=C2NC3=CC=C(C=C3)S(=O)(=O)C)C4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=NN(C2=C1N=C(N=C2NC3=CC=C(C=C3)S(=O)(=O)C)C4=CC=C(C=C4)F)C

InChI

InChI=1S/C20H18FN5O2S/c1-12-17-18(26(2)25-12)20(22-15-8-10-16(11-9-15)29(3,27)28)24-19(23-17)13-4-6-14(21)7-5-13/h4-11H,1-3H3,(H,22,23,24)