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

Systemtic Name: 5-butyl-8-methyl-3-(2-methylpropylsulfanyl)-[1,2,4]triazino[5,6-b]indole Openeye Name: 5-butyl-3-isobutylsulfanyl-8-methyl-[1,2,4]triazino[5,6-b]indole CAS Name: 5-butyl-8-methyl-3-(2-methylpropylthio)-[1,2,4]triazino[5,6-b]indole IUPAC Name: 5-butyl-8-methyl-3-(2-methylpropylsulfanyl)-[1,2,4]triazino[5,6-b]indole Traditional Name: 5-butyl-3-(isobutylthio)-8-methyl-[1,2,4]triazin[5,6-b]indole Formula: C18H24N4S MolecularWeight: 328.47496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N4S/c1-5-6-9-22-15-8-7-13(4)10-14(15)16-17(22)19-18(21-20-16)23-11-12(2)3/h7-8,10,12H,5-6,9,11H2,1-4H3