2-chloranyl-N-[(4-oxidanylidene-2-phenyl-quinazolin-3-yl)carbamothioyl]benzamide

Systemtic Name: 2-chloranyl-N-[(4-oxidanylidene-2-phenyl-quinazolin-3-yl)carbamothioyl]benzamide Openeye Name: 2-chloro-N-[(4-oxo-2-phenyl-quinazolin-3-yl)carbamothioyl]benzamide CAS Name: 2-chloro-N-[[(4-oxo-2-phenyl-3-quinazolinyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-chloro-N-[(4-oxo-2-phenylquinazolin-3-yl)carbamothioyl]benzamide Traditional Name: 2-chloro-N-[(4-keto-2-phenyl-quinazolin-3-yl)thiocarbamoyl]benzamide Formula: C22H15ClN4O2S MolecularWeight: 434.8981

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2NC(=S)NC(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2NC(=S)NC(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H15ClN4O2S/c23-17-12-6-4-10-15(17)20(28)25-22(30)26-27-19(14-8-2-1-3-9-14)24-18-13-7-5-11-16(18)21(27)29/h1-13H,(H2,25,26,28,30)