2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(prop-2-enylcarbamoyl)ethanamide

Systemtic Name: 2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(prop-2-enylcarbamoyl)ethanamide Openeye Name: N-(allylcarbamoyl)-2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: 2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]-N-[oxo-(prop-2-enylamino)methyl]acetamide IUPAC Name: 2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanyl-N-(prop-2-enylcarbamoyl)acetamide Traditional Name: N-(allylcarbamoyl)-2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)NCC=C

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)NCC=C

InChI

InChI=1S/C20H26N4O3S/c1-3-5-6-9-13-24-18(26)15-10-7-8-11-16(15)22-20(24)28-14-17(25)23-19(27)21-12-4-2/h4,7-8,10-11H,2-3,5-6,9,12-14H2,1H3,(H2,21,23,25,27)