1-[(2-ethoxypyridin-3-yl)methyl]-3-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)urea

Systemtic Name: 1-[(2-ethoxypyridin-3-yl)methyl]-3-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)urea Openeye Name: 1-[(2-ethoxy-3-pyridyl)methyl]-3-(6-fluorothiochroman-4-yl)urea CAS Name: 1-[(2-ethoxy-3-pyridinyl)methyl]-3-(6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl)urea IUPAC Name: 1-[(2-ethoxypyridin-3-yl)methyl]-3-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)urea Traditional Name: 1-[(2-ethoxy-3-pyridyl)methyl]-3-(6-fluorothiochroman-4-yl)urea Formula: C18H20FN3O2S MolecularWeight: 361.433703

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)CNC(=O)NC2CCSC3=C2C=C(C=C3)F

Isomeric SMILES

CCOC1=C(C=CC=N1)CNC(=O)NC2CCSC3=C2C=C(C=C3)F

InChI

InChI=1S/C18H20FN3O2S/c1-2-24-17-12(4-3-8-20-17)11-21-18(23)22-15-7-9-25-16-6-5-13(19)10-14(15)16/h3-6,8,10,15H,2,7,9,11H2,1H3,(H2,21,22,23)