2-[(phenylmethyl)amino]-N-[3-(trifluoromethyl)phenyl]-4,5-dihydroimidazole-1-carbothioamide

Systemtic Name: 2-[(phenylmethyl)amino]-N-[3-(trifluoromethyl)phenyl]-4,5-dihydroimidazole-1-carbothioamide Openeye Name: 2-(benzylamino)-N-[3-(trifluoromethyl)phenyl]-4,5-dihydroimidazole-1-carbothioamide CAS Name: 2-[(phenylmethyl)amino]-N-[3-(trifluoromethyl)phenyl]-4,5-dihydroimidazole-1-carbothioamide IUPAC Name: 2-(benzylamino)-N-[3-(trifluoromethyl)phenyl]-4,5-dihydroimidazole-1-carbothioamide Traditional Name: 2-(benzylamino)-N-[3-(trifluoromethyl)phenyl]-2-imidazoline-1-carbothioamide Formula: C18H17F3N4S MolecularWeight: 378.41459

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=N1)NCC2=CC=CC=C2)C(=S)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CN(C(=N1)NCC2=CC=CC=C2)C(=S)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H17F3N4S/c19-18(20,21)14-7-4-8-15(11-14)24-17(26)25-10-9-22-16(25)23-12-13-5-2-1-3-6-13/h1-8,11H,9-10,12H2,(H,22,23)(H,24,26)