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

Systemtic Name: 3-(2-methylpropylsulfanyl)-5-propyl-[1,2,4]triazino[5,6-b]indole Openeye Name: 3-isobutylsulfanyl-5-propyl-[1,2,4]triazino[5,6-b]indole CAS Name: 3-(2-methylpropylthio)-5-propyl-[1,2,4]triazino[5,6-b]indole IUPAC Name: 3-(2-methylpropylsulfanyl)-5-propyl-[1,2,4]triazino[5,6-b]indole Traditional Name: 3-(isobutylthio)-5-propyl-[1,2,4]triazin[5,6-b]indole Formula: C16H20N4S MolecularWeight: 300.4218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(C)C

Isomeric SMILES

CCCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(C)C

InChI

InChI=1S/C16H20N4S/c1-4-9-20-13-8-6-5-7-12(13)14-15(20)17-16(19-18-14)21-10-11(2)3/h5-8,11H,4,9-10H2,1-3H3