3-(3-bromanyl-4-methanethioyl-phenyl)propanenitrile

Systemtic Name: 3-(3-bromanyl-4-methanethioyl-phenyl)propanenitrile Openeye Name: 3-(3-bromo-4-methanethioyl-phenyl)propanenitrile CAS Name: 3-(3-bromo-4-methanethioylphenyl)propanenitrile IUPAC Name: 3-(3-bromo-4-methanethioylphenyl)propanenitrile Traditional Name: 3-(3-bromo-4-thioformyl-phenyl)propionitrile Formula: C10H8BrNS MolecularWeight: 254.14622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CCC#N)Br)C=S

Isomeric SMILES

C1=CC(=C(C=C1CCC#N)Br)C=S

InChI

InChI=1S/C10H8BrNS/c11-10-6-8(2-1-5-12)3-4-9(10)7-13/h3-4,6-7H,1-2H2