2-[2-(4-fluorophenyl)-8-methyl-quinazolin-4-yl]sulfanyl-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[2-(4-fluorophenyl)-8-methyl-quinazolin-4-yl]sulfanyl-1-piperidin-1-yl-ethanone Openeye Name: 2-[2-(4-fluorophenyl)-8-methyl-quinazolin-4-yl]sulfanyl-1-(1-piperidyl)ethanone CAS Name: 2-[[2-(4-fluorophenyl)-8-methyl-4-quinazolinyl]thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[2-(4-fluorophenyl)-8-methylquinazolin-4-yl]sulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-[[2-(4-fluorophenyl)-8-methyl-quinazolin-4-yl]thio]-1-piperidino-ethanone Formula: C22H22FN3OS MolecularWeight: 395.492983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(N=C2SCC(=O)N3CCCCC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=CC2=C1N=C(N=C2SCC(=O)N3CCCCC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H22FN3OS/c1-15-6-5-7-18-20(15)24-21(16-8-10-17(23)11-9-16)25-22(18)28-14-19(27)26-12-3-2-4-13-26/h5-11H,2-4,12-14H2,1H3