S-(3-azanyl-3-oxidanylidene-prop-1-en-2-yl) 3-cyanobenzenecarbothioate

Systemtic Name: S-(3-azanyl-3-oxidanylidene-prop-1-en-2-yl) 3-cyanobenzenecarbothioate Openeye Name: S-(1-carbamoylvinyl) 3-cyanobenzenecarbothioate CAS Name: 3-cyanobenzenecarbothioic acid S-(3-amino-3-oxoprop-1-en-2-yl) ester IUPAC Name: S-(3-amino-3-oxoprop-1-en-2-yl) 3-cyanobenzenecarbothioate Traditional Name: 3-cyanothiobenzoic acid S-(1-carbamoylvinyl) ester Formula: C11H8N2O2S MolecularWeight: 232.25842

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(=O)N)SC(=O)C1=CC=CC(=C1)C#N

Isomeric SMILES

C=C(C(=O)N)SC(=O)C1=CC=CC(=C1)C#N

InChI

InChI=1S/C11H8N2O2S/c1-7(10(13)14)16-11(15)9-4-2-3-8(5-9)6-12/h2-5H,1H2,(H2,13,14)