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

Systemtic Name: 1-(4-bromophenyl)-4-[(3-bromophenyl)methylsulfanyl]pyrazolo[3,4-d]pyrimidine Openeye Name: 1-(4-bromophenyl)-4-[(3-bromophenyl)methylsulfanyl]pyrazolo[3,4-d]pyrimidine CAS Name: 1-(4-bromophenyl)-4-[(3-bromophenyl)methylthio]pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-(4-bromophenyl)-4-[(3-bromophenyl)methylsulfanyl]pyrazolo[3,4-d]pyrimidine Traditional Name: 4-[(3-bromobenzyl)thio]-1-(4-bromophenyl)pyrazolo[3,4-d]pyrimidine Formula: C18H12Br2N4S MolecularWeight: 476.18768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12Br2N4S/c19-13-4-6-15(7-5-13)24-17-16(9-23-24)18(22-11-21-17)25-10-12-2-1-3-14(20)8-12/h1-9,11H,10H2