4-[(2-chlorophenyl)methylsulfanyl]-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-[(2-chlorophenyl)methylsulfanyl]-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidine Openeye Name: 4-[(2-chlorophenyl)methylsulfanyl]-1-(p-tolyl)pyrazolo[3,4-d]pyrimidine CAS Name: 4-[(2-chlorophenyl)methylthio]-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 4-[(2-chlorophenyl)methylsulfanyl]-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidine Traditional Name: 4-[(2-chlorobenzyl)thio]-1-(p-tolyl)pyrazolo[3,4-d]pyrimidine Formula: C19H15ClN4S MolecularWeight: 366.8672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=CC=CC=C4Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=CC=CC=C4Cl

InChI

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