2-azanyl-3-[4-[(5-azanyl-1H-1,2,4-triazol-3-yl)amino]cyclohexyl]propanal

Systemtic Name: 2-azanyl-3-[4-[(5-azanyl-1H-1,2,4-triazol-3-yl)amino]cyclohexyl]propanal Openeye Name: 2-amino-3-[4-[(5-amino-1H-1,2,4-triazol-3-yl)amino]cyclohexyl]propanal CAS Name: 2-amino-3-[4-[(5-amino-1H-1,2,4-triazol-3-yl)amino]cyclohexyl]propanal IUPAC Name: 2-amino-3-[4-[(5-amino-1H-1,2,4-triazol-3-yl)amino]cyclohexyl]propanal Traditional Name: 2-amino-3-[4-[(5-amino-1H-1,2,4-triazol-3-yl)amino]cyclohexyl]propionaldehyde Formula: C11H20N6O MolecularWeight: 252.3161

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CC(C=O)N)NC2=NNC(=N2)N

Isomeric SMILES

C1CC(CCC1CC(C=O)N)NC2=NNC(=N2)N

InChI

InChI=1S/C11H20N6O/c12-8(6-18)5-7-1-3-9(4-2-7)14-11-15-10(13)16-17-11/h6-9H,1-5,12H2,(H4,13,14,15,16,17)