1-ethyl-N,2-bis(4-methylphenyl)-4-phenyl-5,6,7,8-tetrahydroquinolin-1-ium-8-carboximidothioate

Systemtic Name: 1-ethyl-N,2-bis(4-methylphenyl)-4-phenyl-5,6,7,8-tetrahydroquinolin-1-ium-8-carboximidothioate Openeye Name: 1-ethyl-4-phenyl-N,2-bis(p-tolyl)-5,6,7,8-tetrahydroquinolin-1-ium-8-carboximidothioate CAS Name: 1-ethyl-N,2-bis(4-methylphenyl)-4-phenyl-5,6,7,8-tetrahydroquinolin-1-ium-8-carboximidothioate IUPAC Name: 1-ethyl-N,2-bis(4-methylphenyl)-4-phenyl-5,6,7,8-tetrahydroquinolin-1-ium-8-carboximidothioate Traditional Name: 1-ethyl-4-phenyl-N,2-bis(p-tolyl)-5,6,7,8-tetrahydroquinolin-1-ium-8-carboximidothioate Formula: C32H32N2S MolecularWeight: 476.67488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C=C(C2=C1C(CCC2)C(=NC3=CC=C(C=C3)C)[S-])C4=CC=CC=C4)C5=CC=C(C=C5)C

Isomeric SMILES

CC[N+]1=C(C=C(C2=C1C(CCC2)C(=NC3=CC=C(C=C3)C)[S-])C4=CC=CC=C4)C5=CC=C(C=C5)C

InChI

InChI=1S/C32H32N2S/c1-4-34-30(25-17-13-22(2)14-18-25)21-29(24-9-6-5-7-10-24)27-11-8-12-28(31(27)34)32(35)33-26-19-15-23(3)16-20-26/h5-7,9-10,13-21,28H,4,8,11-12H2,1-3H3