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

Systemtic Name: 3,6-bis(phenylsulfanylmethyl)-1,2,4,5-tetrazine Openeye Name: 3,6-bis(phenylsulfanylmethyl)-1,2,4,5-tetrazine CAS Name: 3,6-bis[(phenylthio)methyl]-1,2,4,5-tetrazine IUPAC Name: 3,6-bis(phenylsulfanylmethyl)-1,2,4,5-tetrazine Traditional Name: 3,6-bis[(phenylthio)methyl]-1,2,4,5-tetrazine Formula: C16H14N4S2 MolecularWeight: 326.43916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC2=NN=C(N=N2)CSC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)SCC2=NN=C(N=N2)CSC3=CC=CC=C3

InChI

InChI=1S/C16H14N4S2/c1-3-7-13(8-4-1)21-11-15-17-19-16(20-18-15)12-22-14-9-5-2-6-10-14/h1-10H,11-12H2