2-(2-azanyl-4-bromanyl-phenyl)sulfanylethanenitrile

Systemtic Name: 2-(2-azanyl-4-bromanyl-phenyl)sulfanylethanenitrile Openeye Name: 2-(2-amino-4-bromo-phenyl)sulfanylacetonitrile CAS Name: 2-[(2-amino-4-bromophenyl)thio]acetonitrile IUPAC Name: 2-(2-amino-4-bromophenyl)sulfanylacetonitrile Traditional Name: 2-[(2-amino-4-bromo-phenyl)thio]acetonitrile Formula: C8H7BrN2S MolecularWeight: 243.12358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)N)SCC#N

Isomeric SMILES

C1=CC(=C(C=C1Br)N)SCC#N

InChI

InChI=1S/C8H7BrN2S/c9-6-1-2-8(7(11)5-6)12-4-3-10/h1-2,5H,4,11H2