6-azanylidene-1-(4-chlorophenyl)-2-methylsulfanyl-4-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 6-azanylidene-1-(4-chlorophenyl)-2-methylsulfanyl-4-phenyl-pyrimidine-5-carbonitrile Openeye Name: 1-(4-chlorophenyl)-6-imino-2-methylsulfanyl-4-phenyl-pyrimidine-5-carbonitrile CAS Name: 1-(4-chlorophenyl)-6-imino-2-(methylthio)-4-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 1-(4-chlorophenyl)-6-imino-2-methylsulfanyl-4-phenylpyrimidine-5-carbonitrile Traditional Name: 1-(4-chlorophenyl)-6-imino-2-(methylthio)-4-phenyl-pyrimidine-5-carbonitrile Formula: C18H13ClN4S MolecularWeight: 352.84062

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=N)N1C2=CC=C(C=C2)Cl)C#N)C3=CC=CC=C3

Isomeric SMILES

CSC1=NC(=C(C(=N)N1C2=CC=C(C=C2)Cl)C#N)C3=CC=CC=C3

InChI

InChI=1S/C18H13ClN4S/c1-24-18-22-16(12-5-3-2-4-6-12)15(11-20)17(21)23(18)14-9-7-13(19)8-10-14/h2-10,21H,1H3