2-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfinyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfinyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone Openeye Name: 2-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylsulfinyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone CAS Name: 2-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylsulfinyl]-1-[4-(4-fluorophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfinyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(5-ethoxy-2-methyl-coumaran-6-yl)methylsulfinyl]-1-[4-(4-fluorophenyl)piperazino]ethanone Formula: C24H29FN2O4S MolecularWeight: 460.561463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CS(=O)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)CS(=O)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H29FN2O4S/c1-3-30-22-13-18-12-17(2)31-23(18)14-19(22)15-32(29)16-24(28)27-10-8-26(9-11-27)21-6-4-20(25)5-7-21/h4-7,13-14,17H,3,8-12,15-16H2,1-2H3