2-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanoic acid

Systemtic Name: 2-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanoic acid Openeye Name: 2-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanoic acid CAS Name: 2-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanoic acid IUPAC Name: 2-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanoic acid Traditional Name: 2-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionic acid Formula: C11H10N2O3S MolecularWeight: 250.2737

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1C(=O)C2=CC=CC=C2NC1=S

Isomeric SMILES

CC(C(=O)O)N1C(=O)C2=CC=CC=C2NC1=S

InChI

InChI=1S/C11H10N2O3S/c1-6(10(15)16)13-9(14)7-4-2-3-5-8(7)12-11(13)17/h2-6H,1H3,(H,12,17)(H,15,16)