5-[chloranyl-(4-methylphenyl)sulfonyl-methyl]-6-(4-methylphenyl)-3-phenyl-1,2,4-triazine

Systemtic Name: 5-[chloranyl-(4-methylphenyl)sulfonyl-methyl]-6-(4-methylphenyl)-3-phenyl-1,2,4-triazine Openeye Name: 5-[chloro(p-tolylsulfonyl)methyl]-3-phenyl-6-(p-tolyl)-1,2,4-triazine CAS Name: 5-[chloro-(4-methylphenyl)sulfonylmethyl]-6-(4-methylphenyl)-3-phenyl-1,2,4-triazine IUPAC Name: 5-[chloro-(4-methylphenyl)sulfonylmethyl]-6-(4-methylphenyl)-3-phenyl-1,2,4-triazine Traditional Name: 5-[chloro(tosyl)methyl]-3-phenyl-6-(p-tolyl)-1,2,4-triazine Formula: C24H20ClN3O2S MolecularWeight: 449.9525

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=C(N=N2)C3=CC=CC=C3)C(S(=O)(=O)C4=CC=C(C=C4)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=C(N=N2)C3=CC=CC=C3)C(S(=O)(=O)C4=CC=C(C=C4)C)Cl

InChI

InChI=1S/C24H20ClN3O2S/c1-16-8-12-18(13-9-16)21-22(26-24(28-27-21)19-6-4-3-5-7-19)23(25)31(29,30)20-14-10-17(2)11-15-20/h3-15,23H,1-2H3