N-[4-(cyanomethyl)phenyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-propan-2-ylsulfonyl-thiophene-2-carboxamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-propan-2-ylsulfonyl-thiophene-2-carboxamide Openeye Name: N-[4-(cyanomethyl)phenyl]-N-isopropylsulfonyl-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide CAS Name: N-[4-(cyanomethyl)phenyl]-5-[1-methyl-5-(trifluoromethyl)-3-pyrazolyl]-N-propan-2-ylsulfonyl-2-thiophenecarboxamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-propan-2-ylsulfonylthiophene-2-carboxamide Traditional Name: N-[4-(cyanomethyl)phenyl]-N-isopropylsulfonyl-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide Formula: C21H19F3N4O3S2 MolecularWeight: 496.52577

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N(C1=CC=C(C=C1)CC#N)C(=O)C2=CC=C(S2)C3=NN(C(=C3)C(F)(F)F)C

Isomeric SMILES

CC(C)S(=O)(=O)N(C1=CC=C(C=C1)CC#N)C(=O)C2=CC=C(S2)C3=NN(C(=C3)C(F)(F)F)C

InChI

InChI=1S/C21H19F3N4O3S2/c1-13(2)33(30,31)28(15-6-4-14(5-7-15)10-11-25)20(29)18-9-8-17(32-18)16-12-19(21(22,23)24)27(3)26-16/h4-9,12-13H,10H2,1-3H3