2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-2-phenyl-ethanamide

Systemtic Name: 2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-2-phenyl-ethanamide Openeye Name: 2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-2-phenyl-acetamide CAS Name: 2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]-2-phenylacetamide IUPAC Name: 2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanyl-2-phenylacetamide Traditional Name: 2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]-2-phenyl-acetamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C3=CC=CC=C3)C(=O)N

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C22H25N3O2S/c1-2-3-4-10-15-25-21(27)17-13-8-9-14-18(17)24-22(25)28-19(20(23)26)16-11-6-5-7-12-16/h5-9,11-14,19H,2-4,10,15H2,1H3,(H2,23,26)