5-methyl-3-pentylsulfanyl-[1,2,4]triazino[5,6-b]indole

Systemtic Name: 5-methyl-3-pentylsulfanyl-[1,2,4]triazino[5,6-b]indole Openeye Name: 5-methyl-3-pentylsulfanyl-[1,2,4]triazino[5,6-b]indole CAS Name: 5-methyl-3-(pentylthio)-[1,2,4]triazino[5,6-b]indole IUPAC Name: 5-methyl-3-pentylsulfanyl-[1,2,4]triazino[5,6-b]indole Traditional Name: 3-(amylthio)-5-methyl-[1,2,4]triazin[5,6-b]indole Formula: C15H18N4S MolecularWeight: 286.39522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NC2=C(C3=CC=CC=C3N2C)N=N1

Isomeric SMILES

CCCCCSC1=NC2=C(C3=CC=CC=C3N2C)N=N1

InChI

InChI=1S/C15H18N4S/c1-3-4-7-10-20-15-16-14-13(17-18-15)11-8-5-6-9-12(11)19(14)2/h5-6,8-9H,3-4,7,10H2,1-2H3