6-[4-[2-(4-fluorophenyl)sulfanylethylamino]cyclohexyl]-3H-1,3-benzoxazol-2-one

Systemtic Name: 6-[4-[2-(4-fluorophenyl)sulfanylethylamino]cyclohexyl]-3H-1,3-benzoxazol-2-one Openeye Name: 6-[4-[2-(4-fluorophenyl)sulfanylethylamino]cyclohexyl]-3H-1,3-benzoxazol-2-one CAS Name: 6-[4-[2-[(4-fluorophenyl)thio]ethylamino]cyclohexyl]-3H-1,3-benzoxazol-2-one IUPAC Name: 6-[4-[2-(4-fluorophenyl)sulfanylethylamino]cyclohexyl]-3H-1,3-benzoxazol-2-one Traditional Name: 6-[4-[2-[(4-fluorophenyl)thio]ethylamino]cyclohexyl]-3H-1,3-benzoxazol-2-one Formula: C21H23FN2O2S MolecularWeight: 386.482923

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=CC3=C(C=C2)NC(=O)O3)NCCSC4=CC=C(C=C4)F

Isomeric SMILES

C1CC(CCC1C2=CC3=C(C=C2)NC(=O)O3)NCCSC4=CC=C(C=C4)F

InChI

InChI=1S/C21H23FN2O2S/c22-16-4-8-18(9-5-16)27-12-11-23-17-6-1-14(2-7-17)15-3-10-19-20(13-15)26-21(25)24-19/h3-5,8-10,13-14,17,23H,1-2,6-7,11-12H2,(H,24,25)