N-[2,6-bis(chloranyl)phenyl]-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2,6-bis(chloranyl)phenyl]-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,6-dichlorophenyl)-2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(2,6-dichlorophenyl)-2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-(2,6-dichlorophenyl)-2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(2,6-dichlorophenyl)-2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C22H23Cl2N3O2S MolecularWeight: 464.40792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23Cl2N3O2S/c1-2-3-4-7-13-27-21(29)15-9-5-6-12-18(15)25-22(27)30-14-19(28)26-20-16(23)10-8-11-17(20)24/h5-6,8-12H,2-4,7,13-14H2,1H3,(H,26,28)