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

Systemtic Name: 2-methylsulfanyl-4-phenyl-6-pyrrolidin-1-yl-pyrimidine-5-carbonitrile Openeye Name: 2-methylsulfanyl-4-phenyl-6-pyrrolidin-1-yl-pyrimidine-5-carbonitrile CAS Name: 2-(methylthio)-4-phenyl-6-(1-pyrrolidinyl)-5-pyrimidinecarbonitrile IUPAC Name: 2-methylsulfanyl-4-phenyl-6-pyrrolidin-1-ylpyrimidine-5-carbonitrile Traditional Name: 2-(methylthio)-4-phenyl-6-pyrrolidino-pyrimidine-5-carbonitrile Formula: C16H16N4S MolecularWeight: 296.39004

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=N1)N2CCCC2)C#N)C3=CC=CC=C3

Isomeric SMILES

CSC1=NC(=C(C(=N1)N2CCCC2)C#N)C3=CC=CC=C3

InChI

InChI=1S/C16H16N4S/c1-21-16-18-14(12-7-3-2-4-8-12)13(11-17)15(19-16)20-9-5-6-10-20/h2-4,7-8H,5-6,9-10H2,1H3