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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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