(2S)-N-(2,5-dimethylphenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-2-phenyl-ethanamide

Systemtic Name: (2S)-N-(2,5-dimethylphenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-2-phenyl-ethanamide Openeye Name: (2S)-N-(2,5-dimethylphenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-2-phenyl-acetamide CAS Name: (2S)-N-(2,5-dimethylphenyl)-2-[(2-methyl-4-quinazolinyl)thio]-2-phenylacetamide IUPAC Name: (2S)-N-(2,5-dimethylphenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-2-phenylacetamide Traditional Name: (2S)-N-(2,5-dimethylphenyl)-2-[(2-methylquinazolin-4-yl)thio]-2-phenyl-acetamide Formula: C25H23N3OS MolecularWeight: 413.53462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)SC3=NC(=NC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)[C@H](C2=CC=CC=C2)SC3=NC(=NC4=CC=CC=C43)C

InChI

InChI=1S/C25H23N3OS/c1-16-13-14-17(2)22(15-16)28-24(29)23(19-9-5-4-6-10-19)30-25-20-11-7-8-12-21(20)26-18(3)27-25/h4-15,23H,1-3H3,(H,28,29)/t23-/m0/s1