6,8-bis(chloranyl)-3-(3-chloranyl-4-methyl-phenyl)carbonyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 6,8-bis(chloranyl)-3-(3-chloranyl-4-methyl-phenyl)carbonyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 6,8-dichloro-3-(3-chloro-4-methyl-benzoyl)-2-thioxo-quinazolin-4-olate CAS Name: 6,8-dichloro-3-[(3-chloro-4-methylphenyl)-oxomethyl]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 6,8-dichloro-3-(3-chloro-4-methylbenzoyl)-2-sulfanylidenequinazolin-4-olate Traditional Name: 6,8-dichloro-3-(3-chloro-4-methyl-benzoyl)-2-thioxo-quinazolin-4-olate Formula: C16H8Cl3N2O2S- MolecularWeight: 398.67092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2C(=C3C=C(C=C(C3=NC2=S)Cl)Cl)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2C(=C3C=C(C=C(C3=NC2=S)Cl)Cl)[O-])Cl

InChI

InChI=1S/C16H9Cl3N2O2S/c1-7-2-3-8(4-11(7)18)14(22)21-15(23)10-5-9(17)6-12(19)13(10)20-16(21)24/h2-6,23H,1H3/p-1