3-prop-2-ynylsulfanyl-5H-[1,2,4]triazino[5,6-b]indole

Systemtic Name: 3-prop-2-ynylsulfanyl-5H-[1,2,4]triazino[5,6-b]indole Openeye Name: 3-prop-2-ynylsulfanyl-5H-[1,2,4]triazino[5,6-b]indole CAS Name: 3-(prop-2-ynylthio)-5H-[1,2,4]triazino[5,6-b]indole IUPAC Name: 3-prop-2-ynylsulfanyl-5H-[1,2,4]triazino[5,6-b]indole Traditional Name: 3-(propargylthio)-5H-[1,2,4]triazin[5,6-b]indole Formula: C12H8N4S MolecularWeight: 240.28372

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Descriptors Computed from Structure

Canonical SMILES:

C#CCSC1=NC2=C(C3=CC=CC=C3N2)N=N1

Isomeric SMILES

C#CCSC1=NC2=C(C3=CC=CC=C3N2)N=N1

InChI

InChI=1S/C12H8N4S/c1-2-7-17-12-14-11-10(15-16-12)8-5-3-4-6-9(8)13-11/h1,3-6H,7H2,(H,13,14,16)