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

Systemtic Name: N-(cyclopropylcarbamoyl)-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(cyclopropylcarbamoyl)-2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[(cyclopropylamino)-oxomethyl]-2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-(cyclopropylcarbamoyl)-2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(cyclopropylcarbamoyl)-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)NC3CC3

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)NC3CC3

InChI

InChI=1S/C20H26N4O3S/c1-2-3-4-7-12-24-18(26)15-8-5-6-9-16(15)22-20(24)28-13-17(25)23-19(27)21-14-10-11-14/h5-6,8-9,14H,2-4,7,10-13H2,1H3,(H2,21,23,25,27)