1-(2,4-dimethylphenyl)-4-(pyridin-3-ylmethylsulfanyl)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-(2,4-dimethylphenyl)-4-(pyridin-3-ylmethylsulfanyl)pyrazolo[3,4-d]pyrimidine Openeye Name: 1-(2,4-dimethylphenyl)-4-(3-pyridylmethylsulfanyl)pyrazolo[3,4-d]pyrimidine CAS Name: 1-(2,4-dimethylphenyl)-4-(3-pyridinylmethylthio)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-(2,4-dimethylphenyl)-4-(pyridin-3-ylmethylsulfanyl)pyrazolo[3,4-d]pyrimidine Traditional Name: 1-(2,4-dimethylphenyl)-4-(3-pyridylmethylthio)pyrazolo[3,4-d]pyrimidine Formula: C19H17N5S MolecularWeight: 347.43678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=CN=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=CN=CC=C4)C

InChI

InChI=1S/C19H17N5S/c1-13-5-6-17(14(2)8-13)24-18-16(10-23-24)19(22-12-21-18)25-11-15-4-3-7-20-9-15/h3-10,12H,11H2,1-2H3