N-(1,3-benzothiazol-2-yl)-N-(3-fluoranyl-4-methyl-phenyl)-3-(methylsulfonylmethyl)benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(3-fluoranyl-4-methyl-phenyl)-3-(methylsulfonylmethyl)benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(3-fluoro-4-methyl-phenyl)-3-(methylsulfonylmethyl)benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(3-fluoro-4-methylphenyl)-3-(methylsulfonylmethyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(3-fluoro-4-methylphenyl)-3-(methylsulfonylmethyl)benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(3-fluoro-4-methyl-phenyl)-3-(mesylmethyl)benzamide Formula: C23H19FN2O3S2 MolecularWeight: 454.536963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=CC=C4)CS(=O)(=O)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=CC=C4)CS(=O)(=O)C)F

InChI

InChI=1S/C23H19FN2O3S2/c1-15-10-11-18(13-19(15)24)26(23-25-20-8-3-4-9-21(20)30-23)22(27)17-7-5-6-16(12-17)14-31(2,28)29/h3-13H,14H2,1-2H3