N-methylsulfonyl-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide

Systemtic Name: N-methylsulfonyl-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Openeye Name: N-methylsulfonyl-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide CAS Name: N-methylsulfonyl-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-N-(1,3,5-trimethyl-4-pyrazolyl)propanamide IUPAC Name: N-methylsulfonyl-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Traditional Name: N-mesyl-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-N-(1,3,5-trimethylpyrazol-4-yl)propionamide Formula: C17H19F3N4O5S2 MolecularWeight: 480.48177

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)N(C(=O)C(C)SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=NN1C)C)N(C(=O)C(C)SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C17H19F3N4O5S2/c1-9-15(10(2)22(4)21-9)23(31(5,28)29)16(25)11(3)30-14-7-6-12(17(18,19)20)8-13(14)24(26)27/h6-8,11H,1-5H3