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

Systemtic Name: 2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-prop-2-ynyl-ethanamide Openeye Name: 2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-N-prop-2-ynyl-acetamide CAS Name: 2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]-N-prop-2-ynylacetamide IUPAC Name: 2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanyl-N-prop-2-ynylacetamide Traditional Name: 2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]-N-propargyl-acetamide Formula: C19H23N3O2S MolecularWeight: 357.46982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O2S/c1-3-5-6-9-13-22-18(24)15-10-7-8-11-16(15)21-19(22)25-14-17(23)20-12-4-2/h2,7-8,10-11H,3,5-6,9,12-14H2,1H3,(H,20,23)