[3-bromanyl-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]-pyrrolidin-1-yl-methanethione

Systemtic Name: [3-bromanyl-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]-pyrrolidin-1-yl-methanethione Openeye Name: [3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]-pyrrolidin-1-yl-methanethione CAS Name: [3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]-(1-pyrrolidinyl)methanethione IUPAC Name: [3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]-pyrrolidin-1-ylmethanethione Traditional Name: [3-bromo-4-(2-fluorobenzyl)oxy-5-methoxy-phenyl]-pyrrolidino-methanethione Formula: C19H19BrFNO2S MolecularWeight: 424.327063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=S)N2CCCC2)Br)OCC3=CC=CC=C3F

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=S)N2CCCC2)Br)OCC3=CC=CC=C3F

InChI

InChI=1S/C19H19BrFNO2S/c1-23-17-11-14(19(25)22-8-4-5-9-22)10-15(20)18(17)24-12-13-6-2-3-7-16(13)21/h2-3,6-7,10-11H,4-5,8-9,12H2,1H3