4-(4-isocyano-3-methylsulfanyl-phenyl)benzenecarbonitrile

Systemtic Name: 4-(4-isocyano-3-methylsulfanyl-phenyl)benzenecarbonitrile Openeye Name: 4-(4-isocyano-3-methylsulfanyl-phenyl)benzonitrile CAS Name: 4-[4-isocyano-3-(methylthio)phenyl]benzonitrile IUPAC Name: 4-(4-isocyano-3-methylsulfanylphenyl)benzonitrile Traditional Name: 4-[4-isocyano-3-(methylthio)phenyl]benzonitrile Formula: C15H10N2S MolecularWeight: 250.3183

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC(=C1)C2=CC=C(C=C2)C#N)[N+]#[C-]

Isomeric SMILES

CSC1=C(C=CC(=C1)C2=CC=C(C=C2)C#N)[N+]#[C-]

InChI

InChI=1S/C15H10N2S/c1-17-14-8-7-13(9-15(14)18-2)12-5-3-11(10-16)4-6-12/h3-9H,2H3