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

Systemtic Name: (4-ethoxycarbonyl-1H-pyrazol-5-yl)sulfonyl-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]azanide Openeye Name: (4-ethoxycarbonyl-1H-pyrazol-5-yl)sulfonyl-[2-(1-piperidyl)-5-(trifluoromethyl)phenyl]azanide CAS Name: (4-ethoxycarbonyl-1H-pyrazol-5-yl)sulfonyl-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]azanide IUPAC Name: (4-ethoxycarbonyl-1H-pyrazol-5-yl)sulfonyl-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]azanide Traditional Name: (4-carbethoxy-1H-pyrazol-5-yl)sulfonyl-[2-piperidino-5-(trifluoromethyl)phenyl]azanide Formula: C18H20F3N4O4S- MolecularWeight: 445.43601

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1)S(=O)(=O)[N-]C2=C(C=CC(=C2)C(F)(F)F)N3CCCCC3

Isomeric SMILES

CCOC(=O)C1=C(NN=C1)S(=O)(=O)[N-]C2=C(C=CC(=C2)C(F)(F)F)N3CCCCC3

InChI

InChI=1S/C18H20F3N4O4S/c1-2-29-17(26)13-11-22-23-16(13)30(27,28)24-14-10-12(18(19,20)21)6-7-15(14)25-8-4-3-5-9-25/h6-7,10-11H,2-5,8-9H2,1H3,(H,22,23,26)/q-1