4-(7-chloranyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)benzoic acid

Systemtic Name: 4-(7-chloranyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)benzoic acid Openeye Name: 4-(7-chloro-4-oxo-2-thioxo-1H-quinazolin-3-yl)benzoic acid CAS Name: 4-(7-chloro-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)benzoic acid IUPAC Name: 4-(7-chloro-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)benzoic acid Traditional Name: 4-(7-chloro-4-keto-2-thioxo-1H-quinazolin-3-yl)benzoic acid Formula: C15H9ClN2O3S MolecularWeight: 332.76156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)N2C(=O)C3=C(C=C(C=C3)Cl)NC2=S

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)N2C(=O)C3=C(C=C(C=C3)Cl)NC2=S

InChI

InChI=1S/C15H9ClN2O3S/c16-9-3-6-11-12(7-9)17-15(22)18(13(11)19)10-4-1-8(2-5-10)14(20)21/h1-7H,(H,17,22)(H,20,21)