N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(5-fluoranyl-2-nitro-phenoxy)ethanamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(5-fluoranyl-2-nitro-phenoxy)ethanamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(5-fluoro-2-nitro-phenoxy)acetamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(5-fluoro-2-nitrophenoxy)acetamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(5-fluoro-2-nitrophenoxy)acetamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(5-fluoro-2-nitro-phenoxy)acetamide Formula: C17H14FN3O4S MolecularWeight: 375.374163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)COC3=C(C=CC(=C3)F)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)COC3=C(C=CC(=C3)F)[N+](=O)[O-])C

InChI

InChI=1S/C17H14FN3O4S/c1-9-5-10(2)16-14(6-9)26-17(20-16)19-15(22)8-25-13-7-11(18)3-4-12(13)21(23)24/h3-7H,8H2,1-2H3,(H,19,20,22)