4-(4-chlorophenyl)-2-methylsulfanyl-6-piperidin-1-yl-pyrimidine-5-carbonitrile

Systemtic Name: 4-(4-chlorophenyl)-2-methylsulfanyl-6-piperidin-1-yl-pyrimidine-5-carbonitrile Openeye Name: 4-(4-chlorophenyl)-2-methylsulfanyl-6-(1-piperidyl)pyrimidine-5-carbonitrile CAS Name: 4-(4-chlorophenyl)-2-(methylthio)-6-(1-piperidinyl)-5-pyrimidinecarbonitrile IUPAC Name: 4-(4-chlorophenyl)-2-methylsulfanyl-6-piperidin-1-ylpyrimidine-5-carbonitrile Traditional Name: 4-(4-chlorophenyl)-2-(methylthio)-6-piperidino-pyrimidine-5-carbonitrile Formula: C17H17ClN4S MolecularWeight: 344.86168

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=N1)N2CCCCC2)C#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

CSC1=NC(=C(C(=N1)N2CCCCC2)C#N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H17ClN4S/c1-23-17-20-15(12-5-7-13(18)8-6-12)14(11-19)16(21-17)22-9-3-2-4-10-22/h5-8H,2-4,9-10H2,1H3