5-butyl-3-ethylsulfanyl-8-methyl-[1,2,4]triazino[5,6-b]indole

Systemtic Name: 5-butyl-3-ethylsulfanyl-8-methyl-[1,2,4]triazino[5,6-b]indole Openeye Name: 5-butyl-3-ethylsulfanyl-8-methyl-[1,2,4]triazino[5,6-b]indole CAS Name: 5-butyl-3-(ethylthio)-8-methyl-[1,2,4]triazino[5,6-b]indole IUPAC Name: 5-butyl-3-ethylsulfanyl-8-methyl-[1,2,4]triazino[5,6-b]indole Traditional Name: 5-butyl-3-(ethylthio)-8-methyl-[1,2,4]triazin[5,6-b]indole Formula: C16H20N4S MolecularWeight: 300.4218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)C)C3=C1N=C(N=N3)SCC

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)C)C3=C1N=C(N=N3)SCC

InChI

InChI=1S/C16H20N4S/c1-4-6-9-20-13-8-7-11(3)10-12(13)14-15(20)17-16(19-18-14)21-5-2/h7-8,10H,4-6,9H2,1-3H3