1-(2,4-dimethylphenyl)-4-prop-2-enylsulfanyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-(2,4-dimethylphenyl)-4-prop-2-enylsulfanyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-allylsulfanyl-1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidine CAS Name: 1-(2,4-dimethylphenyl)-4-(prop-2-enylthio)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-(2,4-dimethylphenyl)-4-prop-2-enylsulfanylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-(allylthio)-1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidine Formula: C16H16N4S MolecularWeight: 296.39004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC=C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC=C)C

InChI

InChI=1S/C16H16N4S/c1-4-7-21-16-13-9-19-20(15(13)17-10-18-16)14-6-5-11(2)8-12(14)3/h4-6,8-10H,1,7H2,2-3H3