4-(4-chlorophenyl)-6-(phenylmethylsulfanyl)-2-pyridin-4-yl-pyrimidine-5-carbonitrile

Systemtic Name: 4-(4-chlorophenyl)-6-(phenylmethylsulfanyl)-2-pyridin-4-yl-pyrimidine-5-carbonitrile Openeye Name: 4-benzylsulfanyl-6-(4-chlorophenyl)-2-(4-pyridyl)pyrimidine-5-carbonitrile CAS Name: 4-(4-chlorophenyl)-6-(phenylmethylthio)-2-pyridin-4-yl-5-pyrimidinecarbonitrile IUPAC Name: 4-benzylsulfanyl-6-(4-chlorophenyl)-2-pyridin-4-ylpyrimidine-5-carbonitrile Traditional Name: 4-(benzylthio)-6-(4-chlorophenyl)-2-(4-pyridyl)pyrimidine-5-carbonitrile Formula: C23H15ClN4S MolecularWeight: 414.91

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=NC(=C2C#N)C3=CC=C(C=C3)Cl)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=NC(=C2C#N)C3=CC=C(C=C3)Cl)C4=CC=NC=C4

InChI

InChI=1S/C23H15ClN4S/c24-19-8-6-17(7-9-19)21-20(14-25)23(29-15-16-4-2-1-3-5-16)28-22(27-21)18-10-12-26-13-11-18/h1-13H,15H2