3-phenyl-2-sulfanylidene-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-1H-imidazole-4-carboxamide

Systemtic Name: 3-phenyl-2-sulfanylidene-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-1H-imidazole-4-carboxamide Openeye Name: 3-phenyl-2-thioxo-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-1H-imidazole-4-carboxamide CAS Name: 3-phenyl-2-sulfanylidene-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-1H-imidazole-4-carboxamide IUPAC Name: 3-phenyl-2-sulfanylidene-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-1H-imidazole-4-carboxamide Traditional Name: 3-phenyl-2-thioxo-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-4-imidazoline-4-carboxamide Formula: C20H14F3N3OS MolecularWeight: 401.40487

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CNC2=S)C(=O)NCC#CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CNC2=S)C(=O)NCC#CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H14F3N3OS/c21-20(22,23)15-8-4-6-14(12-15)7-5-11-24-18(27)17-13-25-19(28)26(17)16-9-2-1-3-10-16/h1-4,6,8-10,12-13H,11H2,(H,24,27)(H,25,28)