2-methylsulfanyl-4-(phenethylamino)-6-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 2-methylsulfanyl-4-(phenethylamino)-6-phenyl-pyrimidine-5-carbonitrile Openeye Name: 2-methylsulfanyl-4-(phenethylamino)-6-phenyl-pyrimidine-5-carbonitrile CAS Name: 2-(methylthio)-4-(phenethylamino)-6-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 2-methylsulfanyl-4-(phenethylamino)-6-phenylpyrimidine-5-carbonitrile Traditional Name: 2-(methylthio)-4-(phenethylamino)-6-phenyl-pyrimidine-5-carbonitrile Formula: C20H18N4S MolecularWeight: 346.44872

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=N1)NCCC2=CC=CC=C2)C#N)C3=CC=CC=C3

Isomeric SMILES

CSC1=NC(=C(C(=N1)NCCC2=CC=CC=C2)C#N)C3=CC=CC=C3

InChI

InChI=1S/C20H18N4S/c1-25-20-23-18(16-10-6-3-7-11-16)17(14-21)19(24-20)22-13-12-15-8-4-2-5-9-15/h2-11H,12-13H2,1H3,(H,22,23,24)