(2S)-N-(2,4-dimethylphenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-(2,4-dimethylphenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-propanamide Openeye Name: (2S)-N-(2,4-dimethylphenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-propanamide CAS Name: (2S)-N-(2,4-dimethylphenyl)-2-[(2-methyl-4-quinazolinyl)thio]propanamide IUPAC Name: (2S)-N-(2,4-dimethylphenyl)-2-(2-methylquinazolin-4-yl)sulfanylpropanamide Traditional Name: (2S)-N-(2,4-dimethylphenyl)-2-[(2-methylquinazolin-4-yl)thio]propionamide Formula: C20H21N3OS MolecularWeight: 351.46524

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3OS/c1-12-9-10-17(13(2)11-12)23-19(24)14(3)25-20-16-7-5-6-8-18(16)21-15(4)22-20/h5-11,14H,1-4H3,(H,23,24)/t14-/m0/s1