1-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-3-(3-fluoranyl-4-methyl-phenyl)thiourea

Systemtic Name: 1-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-3-(3-fluoranyl-4-methyl-phenyl)thiourea Openeye Name: 1-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-3-(3-fluoro-4-methyl-phenyl)thiourea CAS Name: 1-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-3-(3-fluoro-4-methylphenyl)thiourea IUPAC Name: 1-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-3-(3-fluoro-4-methylphenyl)thiourea Traditional Name: 1-[[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methyl]-3-(3-fluoro-4-methyl-phenyl)thiourea Formula: C20H23FN2O2S MolecularWeight: 374.472223

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=S)NC3=CC(=C(C=C3)C)F

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)CNC(=S)NC3=CC(=C(C=C3)C)F

InChI

InChI=1S/C20H23FN2O2S/c1-4-24-18-8-14-7-13(3)25-19(14)9-15(18)11-22-20(26)23-16-6-5-12(2)17(21)10-16/h5-6,8-10,13H,4,7,11H2,1-3H3,(H2,22,23,26)/t13-/m0/s1