N-[3-cyano-4-(morpholin-4-ylmethylsulfanyl)phenyl]-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide

Systemtic Name: N-[3-cyano-4-(morpholin-4-ylmethylsulfanyl)phenyl]-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Openeye Name: N-[3-cyano-4-(morpholinomethylsulfanyl)phenyl]-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide CAS Name: N-[3-cyano-4-(4-morpholinylmethylthio)phenyl]-5-methyl-1-[4-(trifluoromethyl)phenyl]-4-pyrazolecarboxamide IUPAC Name: N-[3-cyano-4-(morpholin-4-ylmethylsulfanyl)phenyl]-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Traditional Name: N-[3-cyano-4-(morpholinomethylthio)phenyl]-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Formula: C24H22F3N5O2S MolecularWeight: 501.52399

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)C(F)(F)F)C(=O)NC3=CC(=C(C=C3)SCN4CCOCC4)C#N

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)C(F)(F)F)C(=O)NC3=CC(=C(C=C3)SCN4CCOCC4)C#N

InChI

InChI=1S/C24H22F3N5O2S/c1-16-21(14-29-32(16)20-5-2-18(3-6-20)24(25,26)27)23(33)30-19-4-7-22(17(12-19)13-28)35-15-31-8-10-34-11-9-31/h2-7,12,14H,8-11,15H2,1H3,(H,30,33)