2-[ethyl-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]amino]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[ethyl-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[N-ethyl-2-nitro-4-(trifluoromethylsulfonyl)anilino]-N-(2-thienylmethyl)acetamide CAS Name: 2-[N-ethyl-2-nitro-4-(trifluoromethylsulfonyl)anilino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[N-ethyl-2-nitro-4-(trifluoromethylsulfonyl)anilino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-(N-ethyl-2-nitro-4-triflyl-anilino)-N-(2-thenyl)acetamide Formula: C16H16F3N3O5S2 MolecularWeight: 451.44055

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCC1=CC=CS1)C2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCN(CC(=O)NCC1=CC=CS1)C2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H16F3N3O5S2/c1-2-21(10-15(23)20-9-11-4-3-7-28-11)13-6-5-12(8-14(13)22(24)25)29(26,27)16(17,18)19/h3-8H,2,9-10H2,1H3,(H,20,23)