2-[6-chloranyl-3-[(3,4-dichlorophenyl)methyl]-2-oxidanylidene-4-sulfanylidene-quinazolin-1-yl]ethanoic acid

Systemtic Name: 2-[6-chloranyl-3-[(3,4-dichlorophenyl)methyl]-2-oxidanylidene-4-sulfanylidene-quinazolin-1-yl]ethanoic acid Openeye Name: 2-[6-chloro-3-[(3,4-dichlorophenyl)methyl]-2-oxo-4-thioxo-quinazolin-1-yl]acetic acid CAS Name: 2-[6-chloro-3-[(3,4-dichlorophenyl)methyl]-2-oxo-4-sulfanylidene-1-quinazolinyl]acetic acid IUPAC Name: 2-[6-chloro-3-[(3,4-dichlorophenyl)methyl]-2-oxo-4-sulfanylidenequinazolin-1-yl]acetic acid Traditional Name: 2-[6-chloro-3-(3,4-dichlorobenzyl)-2-keto-4-thioxo-quinazolin-1-yl]acetic acid Formula: C17H11Cl3N2O3S MolecularWeight: 429.70484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CN2C(=S)C3=C(C=CC(=C3)Cl)N(C2=O)CC(=O)O)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1CN2C(=S)C3=C(C=CC(=C3)Cl)N(C2=O)CC(=O)O)Cl)Cl

InChI

InChI=1S/C17H11Cl3N2O3S/c18-10-2-4-14-11(6-10)16(26)22(17(25)21(14)8-15(23)24)7-9-1-3-12(19)13(20)5-9/h1-6H,7-8H2,(H,23,24)