4-(4-chlorophenyl)sulfanyl-2-phenyl-6-(phenylsulfonylmethyl)pyrimidine

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-2-phenyl-6-(phenylsulfonylmethyl)pyrimidine Openeye Name: 4-(benzenesulfonylmethyl)-6-(4-chlorophenyl)sulfanyl-2-phenyl-pyrimidine CAS Name: 4-(benzenesulfonylmethyl)-6-[(4-chlorophenyl)thio]-2-phenylpyrimidine IUPAC Name: 4-(benzenesulfonylmethyl)-6-(4-chlorophenyl)sulfanyl-2-phenylpyrimidine Traditional Name: 4-(besylmethyl)-6-[(4-chlorophenyl)thio]-2-phenyl-pyrimidine Formula: C23H17ClN2O2S2 MolecularWeight: 452.97628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CC(=N2)SC3=CC=C(C=C3)Cl)CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=CC(=N2)SC3=CC=C(C=C3)Cl)CS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H17ClN2O2S2/c24-18-11-13-20(14-12-18)29-22-15-19(16-30(27,28)21-9-5-2-6-10-21)25-23(26-22)17-7-3-1-4-8-17/h1-15H,16H2