4-[(4-tert-butylphenyl)methylsulfanyl]-1-(phenylmethyl)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-[(4-tert-butylphenyl)methylsulfanyl]-1-(phenylmethyl)pyrazolo[3,4-d]pyrimidine Openeye Name: 1-benzyl-4-[(4-tert-butylphenyl)methylsulfanyl]pyrazolo[3,4-d]pyrimidine CAS Name: 4-[(4-tert-butylphenyl)methylthio]-1-(phenylmethyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-benzyl-4-[(4-tert-butylphenyl)methylsulfanyl]pyrazolo[3,4-d]pyrimidine Traditional Name: 1-benzyl-4-[(4-tert-butylbenzyl)thio]pyrazolo[3,4-d]pyrimidine Formula: C23H24N4S MolecularWeight: 388.52846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NC=NC3=C2C=NN3CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NC=NC3=C2C=NN3CC4=CC=CC=C4

InChI

InChI=1S/C23H24N4S/c1-23(2,3)19-11-9-18(10-12-19)15-28-22-20-13-26-27(21(20)24-16-25-22)14-17-7-5-4-6-8-17/h4-13,16H,14-15H2,1-3H3