(2S)-2-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-pentan-2-yl-3-phenyl-propanamide

Systemtic Name: (2S)-2-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-pentan-2-yl-3-phenyl-propanamide Openeye Name: (2S)-N-(1-methylbutyl)-2-(4-oxo-2-thioxo-1H-quinazolin-3-yl)-3-phenyl-propanamide CAS Name: (2S)-2-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-pentan-2-yl-3-phenylpropanamide IUPAC Name: (2S)-2-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-pentan-2-yl-3-phenylpropanamide Traditional Name: (2S)-2-(4-keto-2-thioxo-1H-quinazolin-3-yl)-N-(1-methylbutyl)-3-phenyl-propionamide Formula: C22H25N3O2S MolecularWeight: 395.5178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C(CC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CCCC(C)NC(=O)[C@H](CC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C22H25N3O2S/c1-3-9-15(2)23-20(26)19(14-16-10-5-4-6-11-16)25-21(27)17-12-7-8-13-18(17)24-22(25)28/h4-8,10-13,15,19H,3,9,14H2,1-2H3,(H,23,26)(H,24,28)/t15?,19-/m0/s1