3-[2-(4-bromanylphenoxy)ethylsulfanyl]-5,6-bis(4-methylphenyl)-1,2,4-triazine

Systemtic Name: 3-[2-(4-bromanylphenoxy)ethylsulfanyl]-5,6-bis(4-methylphenyl)-1,2,4-triazine Openeye Name: 3-[2-(4-bromophenoxy)ethylsulfanyl]-5,6-bis(p-tolyl)-1,2,4-triazine CAS Name: 3-[2-(4-bromophenoxy)ethylthio]-5,6-bis(4-methylphenyl)-1,2,4-triazine IUPAC Name: 3-[2-(4-bromophenoxy)ethylsulfanyl]-5,6-bis(4-methylphenyl)-1,2,4-triazine Traditional Name: 3-[2-(4-bromophenoxy)ethylthio]-5,6-bis(p-tolyl)-1,2,4-triazine Formula: C25H22BrN3OS MolecularWeight: 492.43068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=NC(=N2)SCCOC3=CC=C(C=C3)Br)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=NC(=N2)SCCOC3=CC=C(C=C3)Br)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H22BrN3OS/c1-17-3-7-19(8-4-17)23-24(20-9-5-18(2)6-10-20)28-29-25(27-23)31-16-15-30-22-13-11-21(26)12-14-22/h3-14H,15-16H2,1-2H3