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

Systemtic Name: 1-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-3-(4-fluorophenyl)thiourea Openeye Name: 1-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-3-(4-fluorophenyl)thiourea CAS Name: 1-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-3-(4-fluorophenyl)thiourea IUPAC Name: 1-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-3-(4-fluorophenyl)thiourea Traditional Name: 1-[[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methyl]-3-(4-fluorophenyl)thiourea Formula: C19H21FN2O2S MolecularWeight: 360.445643

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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)F

Isomeric SMILES

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

InChI

InChI=1S/C19H21FN2O2S/c1-3-23-17-9-13-8-12(2)24-18(13)10-14(17)11-21-19(25)22-16-6-4-15(20)5-7-16/h4-7,9-10,12H,3,8,11H2,1-2H3,(H2,21,22,25)/t12-/m0/s1