1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone Openeye Name: 1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone CAS Name: 1-[(2S,6S)-2,6-dimethyl-4-morpholinyl]-2-[(2-methyl-4-quinazolinyl)thio]ethanone IUPAC Name: 1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-(2-methylquinazolin-4-yl)sulfanylethanone Traditional Name: 1-[(2S,6S)-2,6-dimethylmorpholino]-2-[(2-methylquinazolin-4-yl)thio]ethanone Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(=O)CSC2=NC(=NC3=CC=CC=C32)C

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)C(=O)CSC2=NC(=NC3=CC=CC=C32)C

InChI

InChI=1S/C17H21N3O2S/c1-11-8-20(9-12(2)22-11)16(21)10-23-17-14-6-4-5-7-15(14)18-13(3)19-17/h4-7,11-12H,8-10H2,1-3H3/t11-,12-/m0/s1