N-[(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]-2-iodanyl-aniline

Systemtic Name: N-[(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]-2-iodanyl-aniline Openeye Name: N-[(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]-2-iodo-aniline CAS Name: N-[(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]-2-iodoaniline IUPAC Name: N-[(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]-2-iodoaniline Traditional Name: (4,5-dimethyl-1,2,4-triazol-3-yl)methyl-(2-iodophenyl)amine Formula: C11H13IN4 MolecularWeight: 328.15219

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)CNC2=CC=CC=C2I

Isomeric SMILES

CC1=NN=C(N1C)CNC2=CC=CC=C2I

InChI

InChI=1S/C11H13IN4/c1-8-14-15-11(16(8)2)7-13-10-6-4-3-5-9(10)12/h3-6,13H,7H2,1-2H3