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

Systemtic Name: N-[3,5-bis(chloranyl)-4-methyl-pyridin-2-yl]-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3,5-dichloro-4-methyl-2-pyridyl)-2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(3,5-dichloro-4-methyl-2-pyridinyl)-2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-(3,5-dichloro-4-methylpyridin-2-yl)-2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(3,5-dichloro-4-methyl-2-pyridyl)-2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C22H24Cl2N4O2S MolecularWeight: 479.42256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=NC=C(C(=C3Cl)C)Cl

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=NC=C(C(=C3Cl)C)Cl

InChI

InChI=1S/C22H24Cl2N4O2S/c1-3-4-5-8-11-28-21(30)15-9-6-7-10-17(15)26-22(28)31-13-18(29)27-20-19(24)14(2)16(23)12-25-20/h6-7,9-10,12H,3-5,8,11,13H2,1-2H3,(H,25,27,29)