4-[5-(6-methoxy-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[5-(6-methoxy-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Openeye Name: 4-[5-(6-methoxy-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide CAS Name: 4-[5-(6-methoxy-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)-1-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[5-(6-methoxy-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Traditional Name: 4-[5-(6-methoxy-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Formula: C18H13F3N4O3S2 MolecularWeight: 454.44603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)C3=CC(=NN3C4=CC=C(C=C4)S(=O)(=O)N)C(F)(F)F

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)C3=CC(=NN3C4=CC=C(C=C4)S(=O)(=O)N)C(F)(F)F

InChI

InChI=1S/C18H13F3N4O3S2/c1-28-11-4-7-13-15(8-11)29-17(23-13)14-9-16(18(19,20)21)24-25(14)10-2-5-12(6-3-10)30(22,26)27/h2-9H,1H3,(H2,22,26,27)