(2S)-2-(7-chloranyl-3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-ethyl-propanamide

Systemtic Name: (2S)-2-(7-chloranyl-3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-ethyl-propanamide Openeye Name: (2S)-2-(7-chloro-3-cyclohexyl-4-oxo-quinazolin-2-yl)sulfanyl-N-ethyl-propanamide CAS Name: (2S)-2-[(7-chloro-3-cyclohexyl-4-oxo-2-quinazolinyl)thio]-N-ethylpropanamide IUPAC Name: (2S)-2-(7-chloro-3-cyclohexyl-4-oxoquinazolin-2-yl)sulfanyl-N-ethylpropanamide Traditional Name: (2S)-2-[(7-chloro-3-cyclohexyl-4-keto-quinazolin-2-yl)thio]-N-ethyl-propionamide Formula: C19H24ClN3O2S MolecularWeight: 393.93076

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)SC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3CCCCC3

Isomeric SMILES

CCNC(=O)[C@H](C)SC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3CCCCC3

InChI

InChI=1S/C19H24ClN3O2S/c1-3-21-17(24)12(2)26-19-22-16-11-13(20)9-10-15(16)18(25)23(19)14-7-5-4-6-8-14/h9-12,14H,3-8H2,1-2H3,(H,21,24)/t12-/m0/s1