5-tert-butyl-3-[[(Z)-2-cyano-3-[4-(trifluoromethyl)phenyl]prop-2-enoyl]amino]thiophene-2-carboxamide

Systemtic Name: 5-tert-butyl-3-[[(Z)-2-cyano-3-[4-(trifluoromethyl)phenyl]prop-2-enoyl]amino]thiophene-2-carboxamide Openeye Name: 5-tert-butyl-3-[[(Z)-2-cyano-3-[4-(trifluoromethyl)phenyl]prop-2-enoyl]amino]thiophene-2-carboxamide CAS Name: 5-tert-butyl-3-[[(Z)-2-cyano-1-oxo-3-[4-(trifluoromethyl)phenyl]prop-2-enyl]amino]-2-thiophenecarboxamide IUPAC Name: 5-tert-butyl-3-[[(Z)-2-cyano-3-[4-(trifluoromethyl)phenyl]prop-2-enoyl]amino]thiophene-2-carboxamide Traditional Name: 5-tert-butyl-3-[[(Z)-2-cyano-3-[4-(trifluoromethyl)phenyl]acryloyl]amino]thiophene-2-carboxamide Formula: C20H18F3N3O2S MolecularWeight: 421.43603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(S1)C(=O)N)NC(=O)C(=CC2=CC=C(C=C2)C(F)(F)F)C#N

Isomeric SMILES

CC(C)(C)C1=CC(=C(S1)C(=O)N)NC(=O)/C(=C\C2=CC=C(C=C2)C(F)(F)F)/C#N

InChI

InChI=1S/C20H18F3N3O2S/c1-19(2,3)15-9-14(16(29-15)17(25)27)26-18(28)12(10-24)8-11-4-6-13(7-5-11)20(21,22)23/h4-9H,1-3H3,(H2,25,27)(H,26,28)/b12-8-