3,6-bis(4-methylphenyl)-1,4-bis-(4-methylphenyl)sulfonyl-1,2,4,5-tetrazine

Systemtic Name: 3,6-bis(4-methylphenyl)-1,4-bis-(4-methylphenyl)sulfonyl-1,2,4,5-tetrazine Openeye Name: 3,6-bis(p-tolyl)-1,4-bis(p-tolylsulfonyl)-1,2,4,5-tetrazine CAS Name: 3,6-bis(4-methylphenyl)-1,4-bis-(4-methylphenyl)sulfonyl-1,2,4,5-tetrazine IUPAC Name: 3,6-bis(4-methylphenyl)-1,4-bis-(4-methylphenyl)sulfonyl-1,2,4,5-tetrazine Traditional Name: 3,6-bis(p-tolyl)-1,4-ditosyl-1,2,4,5-tetrazine Formula: C30H28N4O4S2 MolecularWeight: 572.69772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=NN2S(=O)(=O)C3=CC=C(C=C3)C)C4=CC=C(C=C4)C)S(=O)(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=NN2S(=O)(=O)C3=CC=C(C=C3)C)C4=CC=C(C=C4)C)S(=O)(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C30H28N4O4S2/c1-21-5-13-25(14-6-21)29-31-34(40(37,38)28-19-11-24(4)12-20-28)30(26-15-7-22(2)8-16-26)32-33(29)39(35,36)27-17-9-23(3)10-18-27/h5-20H,1-4H3