2-(7-chloranyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-N-[(2R)-heptan-2-yl]ethanamide

Systemtic Name: 2-(7-chloranyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-N-[(2R)-heptan-2-yl]ethanamide Openeye Name: 2-(7-chloro-4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-N-[(1R)-1-methylhexyl]acetamide CAS Name: 2-[(7-chloro-4-oxo-3-propyl-2-quinazolinyl)thio]-N-[(2R)-heptan-2-yl]acetamide IUPAC Name: 2-(7-chloro-4-oxo-3-propylquinazolin-2-yl)sulfanyl-N-[(2R)-heptan-2-yl]acetamide Traditional Name: 2-[(7-chloro-4-keto-3-propyl-quinazolin-2-yl)thio]-N-[(1R)-1-methylhexyl]acetamide Formula: C20H28ClN3O2S MolecularWeight: 409.97322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CCC

Isomeric SMILES

CCCCC[C@@H](C)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CCC

InChI

InChI=1S/C20H28ClN3O2S/c1-4-6-7-8-14(3)22-18(25)13-27-20-23-17-12-15(21)9-10-16(17)19(26)24(20)11-5-2/h9-10,12,14H,4-8,11,13H2,1-3H3,(H,22,25)/t14-/m1/s1