3-(3-chloranyl-4-methyl-phenyl)carbonyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)carbonyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-(3-chloro-4-methyl-benzoyl)-2-thioxo-quinazolin-4-olate CAS Name: 3-[(3-chloro-4-methylphenyl)-oxomethyl]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-(3-chloro-4-methylbenzoyl)-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-(3-chloro-4-methyl-benzoyl)-2-thioxo-quinazolin-4-olate Formula: C16H10ClN2O2S- MolecularWeight: 329.7808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2C(=C3C=CC=CC3=NC2=S)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2C(=C3C=CC=CC3=NC2=S)[O-])Cl

InChI

InChI=1S/C16H11ClN2O2S/c1-9-6-7-10(8-12(9)17)14(20)19-15(21)11-4-2-3-5-13(11)18-16(19)22/h2-8,21H,1H3/p-1