4-chloranyl-2-[(4-methylphenyl)methylsulfanyl]-6-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-chloranyl-2-[(4-methylphenyl)methylsulfanyl]-6-phenyl-pyrimidine-5-carbonitrile Openeye Name: 4-chloro-6-phenyl-2-(p-tolylmethylsulfanyl)pyrimidine-5-carbonitrile CAS Name: 4-chloro-2-[(4-methylphenyl)methylthio]-6-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 4-chloro-2-[(4-methylphenyl)methylsulfanyl]-6-phenylpyrimidine-5-carbonitrile Traditional Name: 4-chloro-2-[(4-methylbenzyl)thio]-6-phenyl-pyrimidine-5-carbonitrile Formula: C19H14ClN3S MolecularWeight: 351.85256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC(=C(C(=N2)Cl)C#N)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC(=C(C(=N2)Cl)C#N)C3=CC=CC=C3

InChI

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