2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(2,4,4-trimethylpentan-2-yl)ethanamide

Systemtic Name: 2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(2,4,4-trimethylpentan-2-yl)ethanamide Openeye Name: 2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(1,1,3,3-tetramethylbutyl)acetamide CAS Name: 2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-N-(2,4,4-trimethylpentan-2-yl)acetamide IUPAC Name: 2-(3-butyl-4-oxoquinazolin-2-yl)sulfanyl-N-(2,4,4-trimethylpentan-2-yl)acetamide Traditional Name: 2-[(3-butyl-4-keto-quinazolin-2-yl)thio]-N-(1,1,3,3-tetramethylbutyl)acetamide Formula: C22H33N3O2S MolecularWeight: 403.58132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(C)(C)CC(C)(C)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(C)(C)CC(C)(C)C

InChI

InChI=1S/C22H33N3O2S/c1-7-8-13-25-19(27)16-11-9-10-12-17(16)23-20(25)28-14-18(26)24-22(5,6)15-21(2,3)4/h9-12H,7-8,13-15H2,1-6H3,(H,24,26)