2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanoate

Systemtic Name: 2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanoate Openeye Name: 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)sulfanyl]acetate CAS Name: 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)thio]acetate IUPAC Name: 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)sulfanyl]acetate Traditional Name: 2-[(7-chloro-4-keto-1H-quinazolin-2-yl)thio]acetate Formula: C10H6ClN2O3S- MolecularWeight: 269.68424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)NC(=NC2=O)SCC(=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1Cl)NC(=NC2=O)SCC(=O)[O-]

InChI

InChI=1S/C10H7ClN2O3S/c11-5-1-2-6-7(3-5)12-10(13-9(6)16)17-4-8(14)15/h1-3H,4H2,(H,14,15)(H,12,13,16)/p-1