2-(2-imidazol-1-ylethyl)-1,3-bis(2,4,6-trimethylphenyl)guanidine dihydroiodide

Systemtic Name: 2-(2-imidazol-1-ylethyl)-1,3-bis(2,4,6-trimethylphenyl)guanidine dihydroiodide Openeye Name: 2-(2-imidazol-1-ylethyl)-1,3-bis(2,4,6-trimethylphenyl)guanidine dihydroiodide CAS Name: 2-[2-(1-imidazolyl)ethyl]-1,3-bis(2,4,6-trimethylphenyl)guanidine dihydroiodide IUPAC Name: 2-(2-imidazol-1-ylethyl)-1,3-bis(2,4,6-trimethylphenyl)guanidine dihydroiodide Traditional Name: 2-(2-imidazol-1-ylethyl)-1,3-dimesityl-guanidine dihydroiodide Formula: C24H33I2N5 MolecularWeight: 645.36126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=NCCN2C=CN=C2)NC3=C(C=C(C=C3C)C)C)C.I.I

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=NCCN2C=CN=C2)NC3=C(C=C(C=C3C)C)C)C.I.I

InChI

InChI=1S/C24H31N5.2HI/c1-16-11-18(3)22(19(4)12-16)27-24(26-8-10-29-9-7-25-15-29)28-23-20(5)13-17(2)14-21(23)6;;/h7,9,11-15H,8,10H2,1-6H3,(H2,26,27,28);2*1H