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

Systemtic Name: 3-(phenylsulfanylmethyl)-6-thiophen-2-yl-1,2,4,5-tetrazine Openeye Name: 3-(phenylsulfanylmethyl)-6-(2-thienyl)-1,2,4,5-tetrazine CAS Name: 3-[(phenylthio)methyl]-6-thiophen-2-yl-1,2,4,5-tetrazine IUPAC Name: 3-(phenylsulfanylmethyl)-6-thiophen-2-yl-1,2,4,5-tetrazine Traditional Name: 3-[(phenylthio)methyl]-6-(2-thienyl)-1,2,4,5-tetrazine Formula: C13H10N4S2 MolecularWeight: 286.3753

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC2=NN=C(N=N2)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)SCC2=NN=C(N=N2)C3=CC=CS3

InChI

InChI=1S/C13H10N4S2/c1-2-5-10(6-3-1)19-9-12-14-16-13(17-15-12)11-7-4-8-18-11/h1-8H,9H2