2-[[1-phenyl-3-(trifluoromethyl)thieno[2,3-c]pyrazol-5-yl]carbonylamino]ethylazanium

Systemtic Name: 2-[[1-phenyl-3-(trifluoromethyl)thieno[2,3-c]pyrazol-5-yl]carbonylamino]ethylazanium Openeye Name: 2-[[1-phenyl-3-(trifluoromethyl)thieno[2,3-c]pyrazole-5-carbonyl]amino]ethylammonium CAS Name: 2-[[oxo-[1-phenyl-3-(trifluoromethyl)-5-thieno[2,3-c]pyrazolyl]methyl]amino]ethylammonium IUPAC Name: 2-[[1-phenyl-3-(trifluoromethyl)thieno[2,3-c]pyrazole-5-carbonyl]amino]ethylazanium Traditional Name: 2-[[1-phenyl-3-(trifluoromethyl)thieno[2,3-c]pyrazole-5-carbonyl]amino]ethylammonium Formula: C15H14F3N4OS+ MolecularWeight: 355.35807

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=C(S3)C(=O)NCC[NH3+])C(=N2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=C(S3)C(=O)NCC[NH3+])C(=N2)C(F)(F)F

InChI

InChI=1S/C15H13F3N4OS/c16-15(17,18)12-10-8-11(13(23)20-7-6-19)24-14(10)22(21-12)9-4-2-1-3-5-9/h1-5,8H,6-7,19H2,(H,20,23)/p+1