2-[(3-chlorophenyl)methylsulfanyl]-4-methyl-6-phenyl-pyrimidine

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-4-methyl-6-phenyl-pyrimidine Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-4-methyl-6-phenyl-pyrimidine CAS Name: 2-[(3-chlorophenyl)methylthio]-4-methyl-6-phenylpyrimidine IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-4-methyl-6-phenylpyrimidine Traditional Name: 2-[(3-chlorobenzyl)thio]-4-methyl-6-phenyl-pyrimidine Formula: C18H15ClN2S MolecularWeight: 326.8431

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H15ClN2S/c1-13-10-17(15-7-3-2-4-8-15)21-18(20-13)22-12-14-6-5-9-16(19)11-14/h2-11H,12H2,1H3