N-[3,5-bis(chloranyl)pyridin-2-yl]-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[3,5-bis(chloranyl)pyridin-2-yl]-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3,5-dichloro-2-pyridyl)-2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(3,5-dichloro-2-pyridinyl)-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(3,5-dichloropyridin-2-yl)-2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(3,5-dichloro-2-pyridyl)-2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]acetamide Formula: C21H14Cl2N4O2S MolecularWeight: 457.33246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=C(C=N4)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=C(C=N4)Cl)Cl

InChI

InChI=1S/C21H14Cl2N4O2S/c22-13-10-16(23)19(24-11-13)26-18(28)12-30-21-25-17-9-5-4-8-15(17)20(29)27(21)14-6-2-1-3-7-14/h1-11H,12H2,(H,24,26,28)