(2R)-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-(2-methylquinazolin-4-yl)sulfanyl-propan-1-one

Systemtic Name: (2R)-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-(2-methylquinazolin-4-yl)sulfanyl-propan-1-one Openeye Name: (2R)-1-[(2S)-2-methylindolin-1-yl]-2-(2-methylquinazolin-4-yl)sulfanyl-propan-1-one CAS Name: (2R)-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-[(2-methyl-4-quinazolinyl)thio]-1-propanone IUPAC Name: (2R)-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-(2-methylquinazolin-4-yl)sulfanylpropan-1-one Traditional Name: (2R)-1-[(2S)-2-methylindolin-1-yl]-2-[(2-methylquinazolin-4-yl)thio]propan-1-one Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)C(C)SC3=NC(=NC4=CC=CC=C43)C

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1C(=O)[C@@H](C)SC3=NC(=NC4=CC=CC=C43)C

InChI

InChI=1S/C21H21N3OS/c1-13-12-16-8-4-7-11-19(16)24(13)21(25)14(2)26-20-17-9-5-6-10-18(17)22-15(3)23-20/h4-11,13-14H,12H2,1-3H3/t13-,14+/m0/s1