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

Systemtic Name: N-tert-butyl-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-tert-butyl-2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-tert-butyl-2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-tert-butyl-2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-tert-butyl-2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C20H29N3O2S MolecularWeight: 375.52816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29N3O2S/c1-5-6-7-10-13-23-18(25)15-11-8-9-12-16(15)21-19(23)26-14-17(24)22-20(2,3)4/h8-9,11-12H,5-7,10,13-14H2,1-4H3,(H,22,24)