N-[4-(5-chloranyl-2-isocyano-phenyl)-6-piperidin-1-yl-1,3,5-triazin-2-yl]-1H-indazol-3-amine

Systemtic Name: N-[4-(5-chloranyl-2-isocyano-phenyl)-6-piperidin-1-yl-1,3,5-triazin-2-yl]-1H-indazol-3-amine Openeye Name: N-[4-(5-chloro-2-isocyano-phenyl)-6-(1-piperidyl)-1,3,5-triazin-2-yl]-1H-indazol-3-amine CAS Name: N-[4-(5-chloro-2-isocyanophenyl)-6-(1-piperidinyl)-1,3,5-triazin-2-yl]-1H-indazol-3-amine IUPAC Name: N-[4-(5-chloro-2-isocyanophenyl)-6-piperidin-1-yl-1,3,5-triazin-2-yl]-1H-indazol-3-amine Traditional Name: [4-(5-chloro-2-isocyano-phenyl)-6-piperidino-s-triazin-2-yl]-(1H-indazol-3-yl)amine Formula: C22H19ClN8 MolecularWeight: 430.89286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=C(C=C(C=C1)Cl)C2=NC(=NC(=N2)NC3=NNC4=CC=CC=C43)N5CCCCC5

Isomeric SMILES

[C-]#[N+]C1=C(C=C(C=C1)Cl)C2=NC(=NC(=N2)NC3=NNC4=CC=CC=C43)N5CCCCC5

InChI

InChI=1S/C22H19ClN8/c1-24-17-10-9-14(23)13-16(17)19-25-21(28-22(27-19)31-11-5-2-6-12-31)26-20-15-7-3-4-8-18(15)29-30-20/h3-4,7-10,13H,2,5-6,11-12H2,(H2,25,26,27,28,29,30)