3-(4-nitrophenyl)-6-phenyl-1,4-dihydro-1,3,5-triazin-5-ium-2-thione

Systemtic Name: 3-(4-nitrophenyl)-6-phenyl-1,4-dihydro-1,3,5-triazin-5-ium-2-thione Openeye Name: 3-(4-nitrophenyl)-6-phenyl-1,4-dihydro-1,3,5-triazin-5-ium-2-thione CAS Name: 3-(4-nitrophenyl)-6-phenyl-1,4-dihydro-1,3,5-triazin-5-ium-2-thione IUPAC Name: 3-(4-nitrophenyl)-6-phenyl-1,4-dihydro-1,3,5-triazin-5-ium-2-thione Traditional Name: 3-(4-nitrophenyl)-6-phenyl-1,4-dihydro-s-triazin-5-ium-2-thione Formula: C15H13N4O2S+ MolecularWeight: 313.35432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1[NH+]=C(NC(=S)N1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1[NH+]=C(NC(=S)N1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C15H12N4O2S/c20-19(21)13-8-6-12(7-9-13)18-10-16-14(17-15(18)22)11-4-2-1-3-5-11/h1-9H,10H2,(H,16,17,22)/p+1