4-[(4-chlorophenyl)methylsulfanyl]-6-methyl-2-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-[(4-chlorophenyl)methylsulfanyl]-6-methyl-2-phenyl-pyrimidine-5-carbonitrile Openeye Name: 4-[(4-chlorophenyl)methylsulfanyl]-6-methyl-2-phenyl-pyrimidine-5-carbonitrile CAS Name: 4-[(4-chlorophenyl)methylthio]-6-methyl-2-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 4-[(4-chlorophenyl)methylsulfanyl]-6-methyl-2-phenylpyrimidine-5-carbonitrile Traditional Name: 4-[(4-chlorobenzyl)thio]-6-methyl-2-phenyl-pyrimidine-5-carbonitrile Formula: C19H14ClN3S MolecularWeight: 351.85256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CC=C2)SCC3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CC=C2)SCC3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C19H14ClN3S/c1-13-17(11-21)19(24-12-14-7-9-16(20)10-8-14)23-18(22-13)15-5-3-2-4-6-15/h2-10H,12H2,1H3