N-(4-isocyanophenyl)ethanethioamide

Systemtic Name: N-(4-isocyanophenyl)ethanethioamide Openeye Name: N-(4-isocyanophenyl)thioacetamide CAS Name: N-(4-isocyanophenyl)ethanethioamide IUPAC Name: N-(4-isocyanophenyl)ethanethioamide Traditional Name: N-(4-isocyanophenyl)thioacetamide Formula: C9H8N2S MolecularWeight: 176.23822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NC1=CC=C(C=C1)[N+]#[C-]

Isomeric SMILES

CC(=S)NC1=CC=C(C=C1)[N+]#[C-]

InChI

InChI=1S/C9H8N2S/c1-7(12)11-9-5-3-8(10-2)4-6-9/h3-6H,1H3,(H,11,12)