1-[(2S)-2-methylpiperidin-1-yl]-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-[(2S)-2-methylpiperidin-1-yl]-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone Openeye Name: 1-[(2S)-2-methyl-1-piperidyl]-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone CAS Name: 1-[(2S)-2-methyl-1-piperidinyl]-2-[(2-methyl-4-quinazolinyl)thio]ethanone IUPAC Name: 1-[(2S)-2-methylpiperidin-1-yl]-2-(2-methylquinazolin-4-yl)sulfanylethanone Traditional Name: 1-[(2S)-2-methylpiperidino]-2-[(2-methylquinazolin-4-yl)thio]ethanone Formula: C17H21N3OS MolecularWeight: 315.43314

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CSC2=NC(=NC3=CC=CC=C32)C

Isomeric SMILES

C[C@H]1CCCCN1C(=O)CSC2=NC(=NC3=CC=CC=C32)C

InChI

InChI=1S/C17H21N3OS/c1-12-7-5-6-10-20(12)16(21)11-22-17-14-8-3-4-9-15(14)18-13(2)19-17/h3-4,8-9,12H,5-7,10-11H2,1-2H3/t12-/m0/s1