2-[(4-bromophenyl)methylsulfanyl]-1-(4-chlorophenyl)-4,4,6-trimethyl-pyrimidine

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-1-(4-chlorophenyl)-4,4,6-trimethyl-pyrimidine Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]-1-(4-chlorophenyl)-4,4,6-trimethyl-pyrimidine CAS Name: 2-[(4-bromophenyl)methylthio]-1-(4-chlorophenyl)-4,4,6-trimethylpyrimidine IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]-1-(4-chlorophenyl)-4,4,6-trimethylpyrimidine Traditional Name: 2-[(4-bromobenzyl)thio]-1-(4-chlorophenyl)-4,4,6-trimethyl-pyrimidine Formula: C20H20BrClN2S MolecularWeight: 435.8082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N=C(N1C2=CC=C(C=C2)Cl)SCC3=CC=C(C=C3)Br)(C)C

Isomeric SMILES

CC1=CC(N=C(N1C2=CC=C(C=C2)Cl)SCC3=CC=C(C=C3)Br)(C)C

InChI

InChI=1S/C20H20BrClN2S/c1-14-12-20(2,3)23-19(24(14)18-10-8-17(22)9-11-18)25-13-15-4-6-16(21)7-5-15/h4-12H,13H2,1-3H3