4-(4-chlorophenyl)-6-(cyclohexylamino)-2-methylsulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-(4-chlorophenyl)-6-(cyclohexylamino)-2-methylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-(4-chlorophenyl)-6-(cyclohexylamino)-2-methylsulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-(4-chlorophenyl)-6-(cyclohexylamino)-2-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 4-(4-chlorophenyl)-6-(cyclohexylamino)-2-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 4-(4-chlorophenyl)-6-(cyclohexylamino)-2-(methylthio)pyrimidine-5-carbonitrile Formula: C18H19ClN4S MolecularWeight: 358.88826

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=N1)NC2CCCCC2)C#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

CSC1=NC(=C(C(=N1)NC2CCCCC2)C#N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H19ClN4S/c1-24-18-22-16(12-7-9-13(19)10-8-12)15(11-20)17(23-18)21-14-5-3-2-4-6-14/h7-10,14H,2-6H2,1H3,(H,21,22,23)