N-methyl-3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)propanamide

Systemtic Name: N-methyl-3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)propanamide Openeye Name: N-methyl-3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)propanamide CAS Name: N-methyl-3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylthio)propanamide IUPAC Name: N-methyl-3-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)propanamide Traditional Name: N-methyl-3-(5H-[1,2,4]triazin[5,6-b]indol-3-ylthio)propionamide Formula: C13H13N5OS MolecularWeight: 287.34022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CCSC1=NC2=C(C3=CC=CC=C3N2)N=N1

Isomeric SMILES

CNC(=O)CCSC1=NC2=C(C3=CC=CC=C3N2)N=N1

InChI

InChI=1S/C13H13N5OS/c1-14-10(19)6-7-20-13-16-12-11(17-18-13)8-4-2-3-5-9(8)15-12/h2-5H,6-7H2,1H3,(H,14,19)(H,15,16,18)