N-(tert-butylcarbamoyl)-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(tert-butylcarbamoyl)-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(tert-butylcarbamoyl)-2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-[(tert-butylamino)-oxomethyl]-2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-(tert-butylcarbamoyl)-2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(tert-butylcarbamoyl)-2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C22H32N4O3S MolecularWeight: 432.57948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC(=O)NC(C)(C)C

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC(=O)NC(C)(C)C

InChI

InChI=1S/C22H32N4O3S/c1-6-7-8-11-14-26-19(28)16-12-9-10-13-17(16)23-21(26)30-15(2)18(27)24-20(29)25-22(3,4)5/h9-10,12-13,15H,6-8,11,14H2,1-5H3,(H2,24,25,27,29)