5-(2-methylphenyl)-N-[[(3R)-1-phenethylpiperidin-3-yl]methyl]-1,2,4-triazin-3-amine

Systemtic Name: 5-(2-methylphenyl)-N-[[(3R)-1-phenethylpiperidin-3-yl]methyl]-1,2,4-triazin-3-amine Openeye Name: 5-(o-tolyl)-N-[[(3R)-1-phenethyl-3-piperidyl]methyl]-1,2,4-triazin-3-amine CAS Name: 5-(2-methylphenyl)-N-[[(3R)-1-phenethyl-3-piperidinyl]methyl]-1,2,4-triazin-3-amine IUPAC Name: 5-(2-methylphenyl)-N-[[(3R)-1-phenethylpiperidin-3-yl]methyl]-1,2,4-triazin-3-amine Traditional Name: [5-(o-tolyl)-1,2,4-triazin-3-yl]-[[(3R)-1-phenethyl-3-piperidyl]methyl]amine Formula: C24H29N5 MolecularWeight: 387.52056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CN=NC(=N2)NCC3CCCN(C3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C2=CN=NC(=N2)NC[C@H]3CCCN(C3)CCC4=CC=CC=C4

InChI

InChI=1S/C24H29N5/c1-19-8-5-6-12-22(19)23-17-26-28-24(27-23)25-16-21-11-7-14-29(18-21)15-13-20-9-3-2-4-10-20/h2-6,8-10,12,17,21H,7,11,13-16,18H2,1H3,(H,25,27,28)/t21-/m1/s1