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

Systemtic Name: N-aminocarbonyl-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-carbamoyl-2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-carbamoyl-2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-carbamoyl-2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-carbamoyl-2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)N

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)N

InChI

InChI=1S/C17H22N4O3S/c1-2-3-4-7-10-21-15(23)12-8-5-6-9-13(12)19-17(21)25-11-14(22)20-16(18)24/h5-6,8-9H,2-4,7,10-11H2,1H3,(H3,18,20,22,24)