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

Systemtic Name: 4-(diethylamino)-2-methylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile Openeye Name: 4-(diethylamino)-2-methylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile CAS Name: 4-(diethylamino)-2-(methylthio)-6-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 4-(diethylamino)-2-methylsulfanyl-6-phenylpyrimidine-5-carbonitrile Traditional Name: 4-(diethylamino)-2-(methylthio)-6-phenyl-pyrimidine-5-carbonitrile Formula: C16H18N4S MolecularWeight: 298.40592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=NC(=C1C#N)C2=CC=CC=C2)SC

Isomeric SMILES

CCN(CC)C1=NC(=NC(=C1C#N)C2=CC=CC=C2)SC

InChI

InChI=1S/C16H18N4S/c1-4-20(5-2)15-13(11-17)14(18-16(19-15)21-3)12-9-7-6-8-10-12/h6-10H,4-5H2,1-3H3