2-(3-butyl-7-chloranyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanamide

Systemtic Name: 2-(3-butyl-7-chloranyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanamide Openeye Name: 2-(3-butyl-7-chloro-4-oxo-quinazolin-2-yl)sulfanylacetamide CAS Name: 2-[(3-butyl-7-chloro-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: 2-(3-butyl-7-chloro-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-butyl-7-chloro-4-keto-quinazolin-2-yl)thio]acetamide Formula: C14H16ClN3O2S MolecularWeight: 325.81374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N

Isomeric SMILES

CCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N

InChI

InChI=1S/C14H16ClN3O2S/c1-2-3-6-18-13(20)10-5-4-9(15)7-11(10)17-14(18)21-8-12(16)19/h4-5,7H,2-3,6,8H2,1H3,(H2,16,19)