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

Systemtic Name: [3-bromanyl-4-[(3-fluorophenyl)methoxy]-5-methoxy-phenyl]-pyrrolidin-1-yl-methanethione Openeye Name: [3-bromo-4-[(3-fluorophenyl)methoxy]-5-methoxy-phenyl]-pyrrolidin-1-yl-methanethione CAS Name: [3-bromo-4-[(3-fluorophenyl)methoxy]-5-methoxyphenyl]-(1-pyrrolidinyl)methanethione IUPAC Name: [3-bromo-4-[(3-fluorophenyl)methoxy]-5-methoxyphenyl]-pyrrolidin-1-ylmethanethione Traditional Name: [3-bromo-4-(3-fluorobenzyl)oxy-5-methoxy-phenyl]-pyrrolidino-methanethione Formula: C19H19BrFNO2S MolecularWeight: 424.327063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=S)N2CCCC2)Br)OCC3=CC(=CC=C3)F

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=S)N2CCCC2)Br)OCC3=CC(=CC=C3)F

InChI

InChI=1S/C19H19BrFNO2S/c1-23-17-11-14(19(25)22-7-2-3-8-22)10-16(20)18(17)24-12-13-5-4-6-15(21)9-13/h4-6,9-11H,2-3,7-8,12H2,1H3