8-bromanyl-3-prop-2-enylsulfanyl-5H-[1,2,4]triazino[5,6-b]indole

Systemtic Name: 8-bromanyl-3-prop-2-enylsulfanyl-5H-[1,2,4]triazino[5,6-b]indole Openeye Name: 3-allylsulfanyl-8-bromo-5H-[1,2,4]triazino[5,6-b]indole CAS Name: 8-bromo-3-(prop-2-enylthio)-5H-[1,2,4]triazino[5,6-b]indole IUPAC Name: 8-bromo-3-prop-2-enylsulfanyl-5H-[1,2,4]triazino[5,6-b]indole Traditional Name: 3-(allylthio)-8-bromo-5H-[1,2,4]triazin[5,6-b]indole Formula: C12H9BrN4S MolecularWeight: 321.19566

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC2=C(C3=C(N2)C=CC(=C3)Br)N=N1

Isomeric SMILES

C=CCSC1=NC2=C(C3=C(N2)C=CC(=C3)Br)N=N1

InChI

InChI=1S/C12H9BrN4S/c1-2-5-18-12-15-11-10(16-17-12)8-6-7(13)3-4-9(8)14-11/h2-4,6H,1,5H2,(H,14,15,17)