N-(1,3-benzothiazol-2-yl)-N-(3-fluoranyl-4-methyl-phenyl)-2-(4-nitrophenoxy)ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(3-fluoranyl-4-methyl-phenyl)-2-(4-nitrophenoxy)ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(3-fluoro-4-methyl-phenyl)-2-(4-nitrophenoxy)acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(3-fluoro-4-methylphenyl)-2-(4-nitrophenoxy)acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(3-fluoro-4-methylphenyl)-2-(4-nitrophenoxy)acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(3-fluoro-4-methyl-phenyl)-2-(4-nitrophenoxy)acetamide Formula: C22H16FN3O4S MolecularWeight: 437.443543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)COC4=CC=C(C=C4)[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)COC4=CC=C(C=C4)[N+](=O)[O-])F

InChI

InChI=1S/C22H16FN3O4S/c1-14-6-7-16(12-18(14)23)25(22-24-19-4-2-3-5-20(19)31-22)21(27)13-30-17-10-8-15(9-11-17)26(28)29/h2-12H,13H2,1H3