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

Systemtic Name: 4-(4-chlorophenyl)-6-(2-hydroxyethylamino)-2-methylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-(4-chlorophenyl)-6-(2-hydroxyethylamino)-2-methylsulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-(4-chlorophenyl)-6-(2-hydroxyethylamino)-2-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 4-(4-chlorophenyl)-6-(2-hydroxyethylamino)-2-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 4-(4-chlorophenyl)-6-(2-hydroxyethylamino)-2-(methylthio)pyrimidine-5-carbonitrile Formula: C14H13ClN4OS MolecularWeight: 320.79722

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=N1)NCCO)C#N)C2=CC=C(C=C2)Cl

Isomeric SMILES

CSC1=NC(=C(C(=N1)NCCO)C#N)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H13ClN4OS/c1-21-14-18-12(9-2-4-10(15)5-3-9)11(8-16)13(19-14)17-6-7-20/h2-5,20H,6-7H2,1H3,(H,17,18,19)