4-chloranyl-N-[3-(1,2,3-triazol-1-ylmethyl)phenyl]-1,3,5-triazin-2-amine

Systemtic Name: 4-chloranyl-N-[3-(1,2,3-triazol-1-ylmethyl)phenyl]-1,3,5-triazin-2-amine Openeye Name: 4-chloro-N-[3-(triazol-1-ylmethyl)phenyl]-1,3,5-triazin-2-amine CAS Name: 4-chloro-N-[3-(1-triazolylmethyl)phenyl]-1,3,5-triazin-2-amine IUPAC Name: 4-chloro-N-[3-(triazol-1-ylmethyl)phenyl]-1,3,5-triazin-2-amine Traditional Name: (4-chloro-s-triazin-2-yl)-[3-(triazol-1-ylmethyl)phenyl]amine Formula: C12H10ClN7 MolecularWeight: 287.7077

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC(=NC=N2)Cl)CN3C=CN=N3

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC(=NC=N2)Cl)CN3C=CN=N3

InChI

InChI=1S/C12H10ClN7/c13-11-14-8-15-12(18-11)17-10-3-1-2-9(6-10)7-20-5-4-16-19-20/h1-6,8H,7H2,(H,14,15,17,18)