(2S)-N-(2-bromanyl-4-methyl-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-(2-bromanyl-4-methyl-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-propanamide Openeye Name: (2S)-N-(2-bromo-4-methyl-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-propanamide CAS Name: (2S)-N-(2-bromo-4-methylphenyl)-2-[(2-methyl-4-quinazolinyl)thio]propanamide IUPAC Name: (2S)-N-(2-bromo-4-methylphenyl)-2-(2-methylquinazolin-4-yl)sulfanylpropanamide Traditional Name: (2S)-N-(2-bromo-4-methyl-phenyl)-2-[(2-methylquinazolin-4-yl)thio]propionamide Formula: C19H18BrN3OS MolecularWeight: 416.33472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NC(=NC3=CC=CC=C32)C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)[C@H](C)SC2=NC(=NC3=CC=CC=C32)C)Br

InChI

InChI=1S/C19H18BrN3OS/c1-11-8-9-17(15(20)10-11)23-18(24)12(2)25-19-14-6-4-5-7-16(14)21-13(3)22-19/h4-10,12H,1-3H3,(H,23,24)/t12-/m0/s1