(2S)-N-(2-methyl-6-propan-2-yl-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-(2-methyl-6-propan-2-yl-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-propanamide Openeye Name: (2S)-N-(2-isopropyl-6-methyl-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-propanamide CAS Name: (2S)-N-(2-methyl-6-propan-2-ylphenyl)-2-[(2-methyl-4-quinazolinyl)thio]propanamide IUPAC Name: (2S)-N-(2-methyl-6-propan-2-ylphenyl)-2-(2-methylquinazolin-4-yl)sulfanylpropanamide Traditional Name: (2S)-N-(2-isopropyl-6-methyl-phenyl)-2-[(2-methylquinazolin-4-yl)thio]propionamide Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3OS/c1-13(2)17-11-8-9-14(3)20(17)25-21(26)15(4)27-22-18-10-6-7-12-19(18)23-16(5)24-22/h6-13,15H,1-5H3,(H,25,26)/t15-/m0/s1