1-(2-ethylpiperidin-1-yl)-2-(2-phenylquinazolin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(2-ethylpiperidin-1-yl)-2-(2-phenylquinazolin-4-yl)sulfanyl-ethanone Openeye Name: 1-(2-ethyl-1-piperidyl)-2-(2-phenylquinazolin-4-yl)sulfanyl-ethanone CAS Name: 1-(2-ethyl-1-piperidinyl)-2-[(2-phenyl-4-quinazolinyl)thio]ethanone IUPAC Name: 1-(2-ethylpiperidin-1-yl)-2-(2-phenylquinazolin-4-yl)sulfanylethanone Traditional Name: 1-(2-ethylpiperidino)-2-[(2-phenylquinazolin-4-yl)thio]ethanone Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCC1CCCCN1C(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3OS/c1-2-18-12-8-9-15-26(18)21(27)16-28-23-19-13-6-7-14-20(19)24-22(25-23)17-10-4-3-5-11-17/h3-7,10-11,13-14,18H,2,8-9,12,15-16H2,1H3