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

Systemtic Name: [3-bromanyl-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]-piperidin-1-yl-methanethione Openeye Name: [3-bromo-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]-(1-piperidyl)methanethione CAS Name: [3-bromo-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]-(1-piperidinyl)methanethione IUPAC Name: [3-bromo-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]-piperidin-1-ylmethanethione Traditional Name: [3-bromo-5-ethoxy-4-(4-fluorobenzyl)oxy-phenyl]-piperidino-methanethione Formula: C21H23BrFNO2S MolecularWeight: 452.380223

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=S)N2CCCCC2)Br)OCC3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=S)N2CCCCC2)Br)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C21H23BrFNO2S/c1-2-25-19-13-16(21(27)24-10-4-3-5-11-24)12-18(22)20(19)26-14-15-6-8-17(23)9-7-15/h6-9,12-13H,2-5,10-11,14H2,1H3