3-azanyl-4-(4-methylphenyl)sulfanyl-benzenecarbonitrile

Systemtic Name: 3-azanyl-4-(4-methylphenyl)sulfanyl-benzenecarbonitrile Openeye Name: 3-amino-4-(p-tolylsulfanyl)benzonitrile CAS Name: 3-amino-4-[(4-methylphenyl)thio]benzonitrile IUPAC Name: 3-amino-4-(4-methylphenyl)sulfanylbenzonitrile Traditional Name: 3-amino-4-(p-tolylthio)benzonitrile Formula: C14H12N2S MolecularWeight: 240.32348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C#N)N

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C#N)N

InChI

InChI=1S/C14H12N2S/c1-10-2-5-12(6-3-10)17-14-7-4-11(9-15)8-13(14)16/h2-8H,16H2,1H3