(4-ethoxycarbonyl-1H-pyrazol-5-yl)sulfonyl-[2-propoxy-5-(trifluoromethyl)phenyl]azanide

Systemtic Name: (4-ethoxycarbonyl-1H-pyrazol-5-yl)sulfonyl-[2-propoxy-5-(trifluoromethyl)phenyl]azanide Openeye Name: (4-ethoxycarbonyl-1H-pyrazol-5-yl)sulfonyl-[2-propoxy-5-(trifluoromethyl)phenyl]azanide CAS Name: (4-ethoxycarbonyl-1H-pyrazol-5-yl)sulfonyl-[2-propoxy-5-(trifluoromethyl)phenyl]azanide IUPAC Name: (4-ethoxycarbonyl-1H-pyrazol-5-yl)sulfonyl-[2-propoxy-5-(trifluoromethyl)phenyl]azanide Traditional Name: (4-carbethoxy-1H-pyrazol-5-yl)sulfonyl-[2-propoxy-5-(trifluoromethyl)phenyl]azanide Formula: C16H17F3N3O5S- MolecularWeight: 420.38349

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(F)(F)F)[N-]S(=O)(=O)C2=C(C=NN2)C(=O)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(F)(F)F)[N-]S(=O)(=O)C2=C(C=NN2)C(=O)OCC

InChI

InChI=1S/C16H17F3N3O5S/c1-3-7-27-13-6-5-10(16(17,18)19)8-12(13)22-28(24,25)14-11(9-20-21-14)15(23)26-4-2/h5-6,8-9H,3-4,7H2,1-2H3,(H,20,21,23)/q-1