N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-[[3-(trifluoromethyl)pyrazol-1-yl]methyl]furan-2-carboxamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-[[3-(trifluoromethyl)pyrazol-1-yl]methyl]furan-2-carboxamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-[[3-(trifluoromethyl)pyrazol-1-yl]methyl]furan-2-carboxamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-[[3-(trifluoromethyl)-1-pyrazolyl]methyl]-2-furancarboxamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-[[3-(trifluoromethyl)pyrazol-1-yl]methyl]furan-2-carboxamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-5-[[3-(trifluoromethyl)pyrazol-1-yl]methyl]-2-furamide Formula: C18H13F3N4O4S2 MolecularWeight: 470.44543

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(O3)CN4C=CC(=N4)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(O3)CN4C=CC(=N4)C(F)(F)F

InChI

InChI=1S/C18H13F3N4O4S2/c1-31(27,28)11-3-4-12-14(8-11)30-17(22-12)23-16(26)13-5-2-10(29-13)9-25-7-6-15(24-25)18(19,20)21/h2-8H,9H2,1H3,(H,22,23,26)