3-[(4-azanyl-2-chloranyl-phenyl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-[(4-azanyl-2-chloranyl-phenyl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[(4-amino-2-chloro-phenyl)sulfanylmethyl]benzonitrile CAS Name: 3-[[(4-amino-2-chlorophenyl)thio]methyl]benzonitrile IUPAC Name: 3-[(4-amino-2-chlorophenyl)sulfanylmethyl]benzonitrile Traditional Name: 3-[[(4-amino-2-chloro-phenyl)thio]methyl]benzonitrile Formula: C14H11ClN2S MolecularWeight: 274.76854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CSC2=C(C=C(C=C2)N)Cl)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CSC2=C(C=C(C=C2)N)Cl)C#N

InChI

InChI=1S/C14H11ClN2S/c15-13-7-12(17)4-5-14(13)18-9-11-3-1-2-10(6-11)8-16/h1-7H,9,17H2