(2R)-N-(1-cyanocyclohexyl)-N-methyl-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(1-cyanocyclohexyl)-N-methyl-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(1-cyanocyclohexyl)-2-(3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-methyl-propanamide CAS Name: (2R)-N-(1-cyanocyclohexyl)-N-methyl-2-[(4-oxo-3-propan-2-yl-2-quinazolinyl)thio]propanamide IUPAC Name: (2R)-N-(1-cyanocyclohexyl)-N-methyl-2-(4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(1-cyanocyclohexyl)-2-[(3-isopropyl-4-keto-quinazolin-2-yl)thio]-N-methyl-propionamide Formula: C22H28N4O2S MolecularWeight: 412.54832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)N(C)C3(CCCCC3)C#N

Isomeric SMILES

C[C@H](C(=O)N(C)C1(CCCCC1)C#N)SC2=NC3=CC=CC=C3C(=O)N2C(C)C

InChI

InChI=1S/C22H28N4O2S/c1-15(2)26-20(28)17-10-6-7-11-18(17)24-21(26)29-16(3)19(27)25(4)22(14-23)12-8-5-9-13-22/h6-7,10-11,15-16H,5,8-9,12-13H2,1-4H3/t16-/m1/s1