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

Systemtic Name: 5-methyl-3-(2-methylpropylsulfanyl)-[1,2,4]triazino[5,6-b]indole Openeye Name: 3-isobutylsulfanyl-5-methyl-[1,2,4]triazino[5,6-b]indole CAS Name: 5-methyl-3-(2-methylpropylthio)-[1,2,4]triazino[5,6-b]indole IUPAC Name: 5-methyl-3-(2-methylpropylsulfanyl)-[1,2,4]triazino[5,6-b]indole Traditional Name: 3-(isobutylthio)-5-methyl-[1,2,4]triazin[5,6-b]indole Formula: C14H16N4S MolecularWeight: 272.36864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NC2=C(C3=CC=CC=C3N2C)N=N1

Isomeric SMILES

CC(C)CSC1=NC2=C(C3=CC=CC=C3N2C)N=N1

InChI

InChI=1S/C14H16N4S/c1-9(2)8-19-14-15-13-12(16-17-14)10-6-4-5-7-11(10)18(13)3/h4-7,9H,8H2,1-3H3