2-(2-methylquinazolin-4-yl)sulfanyl-1-[4-(phenylmethyl)piperidin-1-yl]ethanone

Systemtic Name: 2-(2-methylquinazolin-4-yl)sulfanyl-1-[4-(phenylmethyl)piperidin-1-yl]ethanone Openeye Name: 1-(4-benzyl-1-piperidyl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanone CAS Name: 2-[(2-methyl-4-quinazolinyl)thio]-1-[4-(phenylmethyl)-1-piperidinyl]ethanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-(2-methylquinazolin-4-yl)sulfanylethanone Traditional Name: 1-(4-benzylpiperidino)-2-[(2-methylquinazolin-4-yl)thio]ethanone Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H25N3OS/c1-17-24-21-10-6-5-9-20(21)23(25-17)28-16-22(27)26-13-11-19(12-14-26)15-18-7-3-2-4-8-18/h2-10,19H,11-16H2,1H3