2-methylsulfanyl-4-phenyl-6-piperidin-1-yl-pyrimidine-5-carbonitrile

Systemtic Name: 2-methylsulfanyl-4-phenyl-6-piperidin-1-yl-pyrimidine-5-carbonitrile Openeye Name: 2-methylsulfanyl-4-phenyl-6-(1-piperidyl)pyrimidine-5-carbonitrile CAS Name: 2-(methylthio)-4-phenyl-6-(1-piperidinyl)-5-pyrimidinecarbonitrile IUPAC Name: 2-methylsulfanyl-4-phenyl-6-piperidin-1-ylpyrimidine-5-carbonitrile Traditional Name: 2-(methylthio)-4-phenyl-6-piperidino-pyrimidine-5-carbonitrile Formula: C17H18N4S MolecularWeight: 310.41662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4S/c1-22-17-19-15(13-8-4-2-5-9-13)14(12-18)16(20-17)21-10-6-3-7-11-21/h2,4-5,8-9H,3,6-7,10-11H2,1H3