4-[[5-(naphthalen-1-yloxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-6-piperidin-1-yl-1,3,5-triazin-2-amine

Systemtic Name: 4-[[5-(naphthalen-1-yloxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-6-piperidin-1-yl-1,3,5-triazin-2-amine Openeye Name: 4-[[5-(1-naphthyloxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-6-(1-piperidyl)-1,3,5-triazin-2-amine CAS Name: 4-[[[5-(1-naphthalenyloxymethyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]-6-(1-piperidinyl)-1,3,5-triazin-2-amine IUPAC Name: 4-[[5-(naphthalen-1-yloxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-6-piperidin-1-yl-1,3,5-triazin-2-amine Traditional Name: [4-[[[5-(1-naphthoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]-6-piperidino-s-triazin-2-yl]amine Formula: C28H28N8OS MolecularWeight: 524.63992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=NC(=N2)CSC3=NN=C(N3C4=CC=CC=C4)COC5=CC=CC6=CC=CC=C65)N

Isomeric SMILES

C1CCN(CC1)C2=NC(=NC(=N2)CSC3=NN=C(N3C4=CC=CC=C4)COC5=CC=CC6=CC=CC=C65)N

InChI

InChI=1S/C28H28N8OS/c29-26-30-24(31-27(32-26)35-16-7-2-8-17-35)19-38-28-34-33-25(36(28)21-12-3-1-4-13-21)18-37-23-15-9-11-20-10-5-6-14-22(20)23/h1,3-6,9-15H,2,7-8,16-19H2,(H2,29,30,31,32)