3-[(4-bromophenyl)methylsulfanyl]-5,6-bis(4-methylphenyl)-1,2,4-triazine

Systemtic Name: 3-[(4-bromophenyl)methylsulfanyl]-5,6-bis(4-methylphenyl)-1,2,4-triazine Openeye Name: 3-[(4-bromophenyl)methylsulfanyl]-5,6-bis(p-tolyl)-1,2,4-triazine CAS Name: 3-[(4-bromophenyl)methylthio]-5,6-bis(4-methylphenyl)-1,2,4-triazine IUPAC Name: 3-[(4-bromophenyl)methylsulfanyl]-5,6-bis(4-methylphenyl)-1,2,4-triazine Traditional Name: 3-[(4-bromobenzyl)thio]-5,6-bis(p-tolyl)-1,2,4-triazine Formula: C24H20BrN3S MolecularWeight: 462.4047

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=NC(=N2)SCC3=CC=C(C=C3)Br)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=NC(=N2)SCC3=CC=C(C=C3)Br)C4=CC=C(C=C4)C

InChI

InChI=1S/C24H20BrN3S/c1-16-3-9-19(10-4-16)22-23(20-11-5-17(2)6-12-20)27-28-24(26-22)29-15-18-7-13-21(25)14-8-18/h3-14H,15H2,1-2H3