2-(4-azanyl-3-chloranyl-phenyl)sulfanylethanenitrile

Systemtic Name: 2-(4-azanyl-3-chloranyl-phenyl)sulfanylethanenitrile Openeye Name: 2-(4-amino-3-chloro-phenyl)sulfanylacetonitrile CAS Name: 2-[(4-amino-3-chlorophenyl)thio]acetonitrile IUPAC Name: 2-(4-amino-3-chlorophenyl)sulfanylacetonitrile Traditional Name: 2-[(4-amino-3-chloro-phenyl)thio]acetonitrile Formula: C8H7ClN2S MolecularWeight: 198.67258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1SCC#N)Cl)N

Isomeric SMILES

C1=CC(=C(C=C1SCC#N)Cl)N

InChI

InChI=1S/C8H7ClN2S/c9-7-5-6(12-4-3-10)1-2-8(7)11/h1-2,5H,4,11H2