2-[[(4S)-5-oxidanylidene-2-phenyl-4-(trifluoromethyl)-1H-imidazol-4-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

Systemtic Name: 2-[[(4S)-5-oxidanylidene-2-phenyl-4-(trifluoromethyl)-1H-imidazol-4-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Openeye Name: 2-[[(4S)-5-oxo-2-phenyl-4-(trifluoromethyl)-1H-imidazol-4-yl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile CAS Name: 2-[[(4S)-5-oxo-2-phenyl-4-(trifluoromethyl)-1H-imidazol-4-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile IUPAC Name: 2-[[(4S)-5-oxo-2-phenyl-4-(trifluoromethyl)-1H-imidazol-4-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Traditional Name: 2-[[(4S)-5-keto-2-phenyl-4-(trifluoromethyl)-2-imidazolin-4-yl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile Formula: C19H15F3N4OS MolecularWeight: 404.40881

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC3(C(=O)NC(=N3)C4=CC=CC=C4)C(F)(F)F)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)N[C@]3(C(=O)NC(=N3)C4=CC=CC=C4)C(F)(F)F)C#N

InChI

InChI=1S/C19H15F3N4OS/c20-19(21,22)18(17(27)24-15(25-18)11-6-2-1-3-7-11)26-16-13(10-23)12-8-4-5-9-14(12)28-16/h1-3,6-7,26H,4-5,8-9H2,(H,24,25,27)/t18-/m1/s1