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

Systemtic Name: [3-bromanyl-4-[(3-fluorophenyl)methoxy]-5-methoxy-phenyl]-piperidin-1-yl-methanethione Openeye Name: [3-bromo-4-[(3-fluorophenyl)methoxy]-5-methoxy-phenyl]-(1-piperidyl)methanethione CAS Name: [3-bromo-4-[(3-fluorophenyl)methoxy]-5-methoxyphenyl]-(1-piperidinyl)methanethione IUPAC Name: [3-bromo-4-[(3-fluorophenyl)methoxy]-5-methoxyphenyl]-piperidin-1-ylmethanethione Traditional Name: [3-bromo-4-(3-fluorobenzyl)oxy-5-methoxy-phenyl]-piperidino-methanethione Formula: C20H21BrFNO2S MolecularWeight: 438.353643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=S)N2CCCCC2)Br)OCC3=CC(=CC=C3)F

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=S)N2CCCCC2)Br)OCC3=CC(=CC=C3)F

InChI

InChI=1S/C20H21BrFNO2S/c1-24-18-12-15(20(26)23-8-3-2-4-9-23)11-17(21)19(18)25-13-14-6-5-7-16(22)10-14/h5-7,10-12H,2-4,8-9,13H2,1H3