2-(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-[(1S,2R)-2-methylcyclohexyl]ethanamide

Systemtic Name: 2-(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-[(1S,2R)-2-methylcyclohexyl]ethanamide Openeye Name: 2-(7-chloro-3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[(1S,2R)-2-methylcyclohexyl]acetamide CAS Name: 2-[(7-chloro-4-oxo-3-propan-2-yl-2-quinazolinyl)thio]-N-[(1S,2R)-2-methylcyclohexyl]acetamide IUPAC Name: 2-(7-chloro-4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanyl-N-[(1S,2R)-2-methylcyclohexyl]acetamide Traditional Name: 2-[(7-chloro-3-isopropyl-4-keto-quinazolin-2-yl)thio]-N-[(1S,2R)-2-methylcyclohexyl]acetamide Formula: C20H26ClN3O2S MolecularWeight: 407.95734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C(C)C

Isomeric SMILES

C[C@@H]1CCCC[C@@H]1NC(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C(C)C

InChI

InChI=1S/C20H26ClN3O2S/c1-12(2)24-19(26)15-9-8-14(21)10-17(15)23-20(24)27-11-18(25)22-16-7-5-4-6-13(16)3/h8-10,12-13,16H,4-7,11H2,1-3H3,(H,22,25)/t13-,16+/m1/s1