3-(4-tert-butylphenyl)-6-prop-2-enylsulfanyl-1,4-dihydro-1,2,4,5-tetrazine

Systemtic Name: 3-(4-tert-butylphenyl)-6-prop-2-enylsulfanyl-1,4-dihydro-1,2,4,5-tetrazine Openeye Name: 3-allylsulfanyl-6-(4-tert-butylphenyl)-1,4-dihydro-1,2,4,5-tetrazine CAS Name: 3-(4-tert-butylphenyl)-6-(prop-2-enylthio)-1,4-dihydro-1,2,4,5-tetrazine IUPAC Name: 3-(4-tert-butylphenyl)-6-prop-2-enylsulfanyl-1,4-dihydro-1,2,4,5-tetrazine Traditional Name: 3-(allylthio)-6-(4-tert-butylphenyl)-1,4-dihydro-1,2,4,5-tetrazine Formula: C15H20N4S MolecularWeight: 288.4111

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NNC(=NN2)SCC=C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NNC(=NN2)SCC=C

InChI

InChI=1S/C15H20N4S/c1-5-10-20-14-18-16-13(17-19-14)11-6-8-12(9-7-11)15(2,3)4/h5-9H,1,10H2,2-4H3,(H,16,17)(H,18,19)