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

Systemtic Name: 3-[(4-azanyl-2-chloranyl-phenyl)sulfanylmethyl]-4-fluoranyl-benzenecarbonitrile Openeye Name: 3-[(4-amino-2-chloro-phenyl)sulfanylmethyl]-4-fluoro-benzonitrile CAS Name: 3-[[(4-amino-2-chlorophenyl)thio]methyl]-4-fluorobenzonitrile IUPAC Name: 3-[(4-amino-2-chlorophenyl)sulfanylmethyl]-4-fluorobenzonitrile Traditional Name: 3-[[(4-amino-2-chloro-phenyl)thio]methyl]-4-fluoro-benzonitrile Formula: C14H10ClFN2S MolecularWeight: 292.759003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)CSC2=C(C=C(C=C2)N)Cl)F

Isomeric SMILES

C1=CC(=C(C=C1C#N)CSC2=C(C=C(C=C2)N)Cl)F

InChI

InChI=1S/C14H10ClFN2S/c15-12-6-11(18)2-4-14(12)19-8-10-5-9(7-17)1-3-13(10)16/h1-6H,8,18H2