N-[4-oxidanylidene-4-[[4-pyrazol-1-yl-2-(trifluoromethyl)phenyl]amino]butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-oxidanylidene-4-[[4-pyrazol-1-yl-2-(trifluoromethyl)phenyl]amino]butyl]thiophene-3-carboxamide Openeye Name: N-[4-oxo-4-[4-pyrazol-1-yl-2-(trifluoromethyl)anilino]butyl]thiophene-3-carboxamide CAS Name: N-[4-oxo-4-[4-(1-pyrazolyl)-2-(trifluoromethyl)anilino]butyl]-3-thiophenecarboxamide IUPAC Name: N-[4-oxo-4-[4-pyrazol-1-yl-2-(trifluoromethyl)anilino]butyl]thiophene-3-carboxamide Traditional Name: N-[4-keto-4-[4-pyrazol-1-yl-2-(trifluoromethyl)anilino]butyl]thiophene-3-carboxamide Formula: C19H17F3N4O2S MolecularWeight: 422.42409

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC(=C(C=C2)NC(=O)CCCNC(=O)C3=CSC=C3)C(F)(F)F

Isomeric SMILES

C1=CN(N=C1)C2=CC(=C(C=C2)NC(=O)CCCNC(=O)C3=CSC=C3)C(F)(F)F

InChI

InChI=1S/C19H17F3N4O2S/c20-19(21,22)15-11-14(26-9-2-8-24-26)4-5-16(15)25-17(27)3-1-7-23-18(28)13-6-10-29-12-13/h2,4-6,8-12H,1,3,7H2,(H,23,28)(H,25,27)