N-(heptanoylamino)-4-methylsulfinyl-N-[2-(trifluoromethyl)phenyl]pyrazole-1-carboximidamide

Systemtic Name: N-(heptanoylamino)-4-methylsulfinyl-N-[2-(trifluoromethyl)phenyl]pyrazole-1-carboximidamide Openeye Name: N-(heptanoylamino)-4-methylsulfinyl-N-[2-(trifluoromethyl)phenyl]pyrazole-1-carboxamidine CAS Name: 4-methylsulfinyl-N-(1-oxoheptylamino)-N-[2-(trifluoromethyl)phenyl]-1-pyrazolecarboximidamide IUPAC Name: N-(heptanoylamino)-4-methylsulfinyl-N-[2-(trifluoromethyl)phenyl]pyrazole-1-carboximidamide Traditional Name: N-(enanthylamino)-4-methylsulfinyl-N-[2-(trifluoromethyl)phenyl]pyrazole-1-carboxamidine Formula: C19H24F3N5O2S MolecularWeight: 443.48637

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NN(C1=CC=CC=C1C(F)(F)F)C(=N)N2C=C(C=N2)S(=O)C

Isomeric SMILES

CCCCCCC(=O)NN(C1=CC=CC=C1C(F)(F)F)C(=N)N2C=C(C=N2)S(=O)C

InChI

InChI=1S/C19H24F3N5O2S/c1-3-4-5-6-11-17(28)25-27(16-10-8-7-9-15(16)19(20,21)22)18(23)26-13-14(12-24-26)30(2)29/h7-10,12-13,23H,3-6,11H2,1-2H3,(H,25,28)