1-(4-chlorophenyl)-4-[(3-methylphenyl)methylsulfanyl]pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-(4-chlorophenyl)-4-[(3-methylphenyl)methylsulfanyl]pyrazolo[3,4-d]pyrimidine Openeye Name: 1-(4-chlorophenyl)-4-(m-tolylmethylsulfanyl)pyrazolo[3,4-d]pyrimidine CAS Name: 1-(4-chlorophenyl)-4-[(3-methylphenyl)methylthio]pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-(4-chlorophenyl)-4-[(3-methylphenyl)methylsulfanyl]pyrazolo[3,4-d]pyrimidine Traditional Name: 1-(4-chlorophenyl)-4-[(3-methylbenzyl)thio]pyrazolo[3,4-d]pyrimidine Formula: C19H15ClN4S MolecularWeight: 366.8672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H15ClN4S/c1-13-3-2-4-14(9-13)11-25-19-17-10-23-24(18(17)21-12-22-19)16-7-5-15(20)6-8-16/h2-10,12H,11H2,1H3