4-[(4-fluorophenyl)methylamino]-2-methylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-[(4-fluorophenyl)methylamino]-2-methylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile Openeye Name: 4-[(4-fluorophenyl)methylamino]-2-methylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile CAS Name: 4-[(4-fluorophenyl)methylamino]-2-(methylthio)-6-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 4-[(4-fluorophenyl)methylamino]-2-methylsulfanyl-6-phenylpyrimidine-5-carbonitrile Traditional Name: 4-[(4-fluorobenzyl)amino]-2-(methylthio)-6-phenyl-pyrimidine-5-carbonitrile Formula: C19H15FN4S MolecularWeight: 350.412603

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=N1)NCC2=CC=C(C=C2)F)C#N)C3=CC=CC=C3

Isomeric SMILES

CSC1=NC(=C(C(=N1)NCC2=CC=C(C=C2)F)C#N)C3=CC=CC=C3

InChI

InChI=1S/C19H15FN4S/c1-25-19-23-17(14-5-3-2-4-6-14)16(11-21)18(24-19)22-12-13-7-9-15(20)10-8-13/h2-10H,12H2,1H3,(H,22,23,24)