[3-bromanyl-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]-(4-methylpiperidin-1-yl)methanethione

Systemtic Name: [3-bromanyl-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]-(4-methylpiperidin-1-yl)methanethione Openeye Name: [3-bromo-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]-(4-methyl-1-piperidyl)methanethione CAS Name: [3-bromo-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]-(4-methyl-1-piperidinyl)methanethione IUPAC Name: [3-bromo-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]-(4-methylpiperidin-1-yl)methanethione Traditional Name: [3-bromo-5-ethoxy-4-(4-fluorobenzyl)oxy-phenyl]-(4-methylpiperidino)methanethione Formula: C22H25BrFNO2S MolecularWeight: 466.406803

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=S)N2CCC(CC2)C)Br)OCC3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=S)N2CCC(CC2)C)Br)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C22H25BrFNO2S/c1-3-26-20-13-17(22(28)25-10-8-15(2)9-11-25)12-19(23)21(20)27-14-16-4-6-18(24)7-5-16/h4-7,12-13,15H,3,8-11,14H2,1-2H3