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

Systemtic Name: S-(3-azanyl-3-oxidanylidene-prop-1-en-2-yl) quinoline-2-carbothioate Openeye Name: S-(1-carbamoylvinyl) quinoline-2-carbothioate CAS Name: 2-quinolinecarbothioic acid S-(3-amino-3-oxoprop-1-en-2-yl) ester IUPAC Name: S-(3-amino-3-oxoprop-1-en-2-yl) quinoline-2-carbothioate Traditional Name: quinoline-2-carbothioic acid S-(1-carbamoylvinyl) ester Formula: C13H10N2O2S MolecularWeight: 258.2957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C(C(=O)N)SC(=O)C1=NC2=CC=CC=C2C=C1

Isomeric SMILES

C=C(C(=O)N)SC(=O)C1=NC2=CC=CC=C2C=C1

InChI

InChI=1S/C13H10N2O2S/c1-8(12(14)16)18-13(17)11-7-6-9-4-2-3-5-10(9)15-11/h2-7H,1H2,(H2,14,16)