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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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