4-methylsulfanyl-6-phenacylsulfanyl-2-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-methylsulfanyl-6-phenacylsulfanyl-2-phenyl-pyrimidine-5-carbonitrile Openeye Name: 4-methylsulfanyl-6-phenacylsulfanyl-2-phenyl-pyrimidine-5-carbonitrile CAS Name: 4-(methylthio)-6-(phenacylthio)-2-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 4-methylsulfanyl-6-phenacylsulfanyl-2-phenylpyrimidine-5-carbonitrile Traditional Name: 4-(methylthio)-6-(phenacylthio)-2-phenyl-pyrimidine-5-carbonitrile Formula: C20H15N3OS2 MolecularWeight: 377.4826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15N3OS2/c1-25-19-16(12-21)20(23-18(22-19)15-10-6-3-7-11-15)26-13-17(24)14-8-4-2-5-9-14/h2-11H,13H2,1H3