(2R)-2-(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-cycloheptyl-propanamide

Systemtic Name: (2R)-2-(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-cycloheptyl-propanamide Openeye Name: (2R)-2-(7-chloro-3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-cycloheptyl-propanamide CAS Name: (2R)-2-[(7-chloro-4-oxo-3-propan-2-yl-2-quinazolinyl)thio]-N-cycloheptylpropanamide IUPAC Name: (2R)-2-(7-chloro-4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanyl-N-cycloheptylpropanamide Traditional Name: (2R)-2-[(7-chloro-3-isopropyl-4-keto-quinazolin-2-yl)thio]-N-cycloheptyl-propionamide Formula: C21H28ClN3O2S MolecularWeight: 421.98392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NC3CCCCCC3

Isomeric SMILES

C[C@H](C(=O)NC1CCCCCC1)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C(C)C

InChI

InChI=1S/C21H28ClN3O2S/c1-13(2)25-20(27)17-11-10-15(22)12-18(17)24-21(25)28-14(3)19(26)23-16-8-6-4-5-7-9-16/h10-14,16H,4-9H2,1-3H3,(H,23,26)/t14-/m1/s1