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

Systemtic Name: N-[3,5-bis(chloranyl)pyridin-2-yl]-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(3,5-dichloro-2-pyridyl)-2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(3,5-dichloro-2-pyridinyl)-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]propanamide IUPAC Name: N-(3,5-dichloropyridin-2-yl)-2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(3,5-dichloro-2-pyridyl)-2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]propionamide Formula: C22H16Cl2N4O2S MolecularWeight: 471.35904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=N1)Cl)Cl)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=N1)Cl)Cl)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C22H16Cl2N4O2S/c1-13(20(29)27-19-17(24)11-14(23)12-25-19)31-22-26-18-10-6-5-9-16(18)21(30)28(22)15-7-3-2-4-8-15/h2-13H,1H3,(H,25,27,29)