N-tert-butyl-2-(7-chloranyl-3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-tert-butyl-2-(7-chloranyl-3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-tert-butyl-2-(7-chloro-3-cyclohexyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-tert-butyl-2-[(7-chloro-3-cyclohexyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-tert-butyl-2-(7-chloro-3-cyclohexyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-tert-butyl-2-[(7-chloro-3-cyclohexyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C20H26ClN3O2S MolecularWeight: 407.95734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3CCCCC3

Isomeric SMILES

CC(C)(C)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3CCCCC3

InChI

InChI=1S/C20H26ClN3O2S/c1-20(2,3)23-17(25)12-27-19-22-16-11-13(21)9-10-15(16)18(26)24(19)14-7-5-4-6-8-14/h9-11,14H,4-8,12H2,1-3H3,(H,23,25)