6-[2-(4-fluorophenyl)imino-3-(2-methylpropyl)-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(4-fluorophenyl)imino-3-(2-methylpropyl)-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(4-fluorophenyl)imino-3-isobutyl-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-(4-fluorophenyl)imino-3-(2-methylpropyl)-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(4-fluorophenyl)imino-3-(2-methylpropyl)-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-(4-fluorophenyl)imino-3-isobutyl-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C21H20FN3O2S MolecularWeight: 397.465803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CSC1=NC2=CC=C(C=C2)F)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

CC(C)CN1C(=CSC1=NC2=CC=C(C=C2)F)C3=CC4=C(C=C3)OCC(=O)N4

InChI

InChI=1S/C21H20FN3O2S/c1-13(2)10-25-18(12-28-21(25)23-16-6-4-15(22)5-7-16)14-3-8-19-17(9-14)24-20(26)11-27-19/h3-9,12-13H,10-11H2,1-2H3,(H,24,26)