N-butyl-2-(7-chloranyl-4-oxidanylidene-3-pentyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-butyl-2-(7-chloranyl-4-oxidanylidene-3-pentyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-butyl-2-(7-chloro-4-oxo-3-pentyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-butyl-2-[(7-chloro-4-oxo-3-pentyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-butyl-2-(7-chloro-4-oxo-3-pentylquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-amyl-7-chloro-4-keto-quinazolin-2-yl)thio]-N-butyl-acetamide Formula: C19H26ClN3O2S MolecularWeight: 395.94664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NCCCC

Isomeric SMILES

CCCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NCCCC

InChI

InChI=1S/C19H26ClN3O2S/c1-3-5-7-11-23-18(25)15-9-8-14(20)12-16(15)22-19(23)26-13-17(24)21-10-6-4-2/h8-9,12H,3-7,10-11,13H2,1-2H3,(H,21,24)