5-tert-butyl-2-(3-iodanyl-4-methyl-phenyl)pyrazol-3-amine

Systemtic Name: 5-tert-butyl-2-(3-iodanyl-4-methyl-phenyl)pyrazol-3-amine Openeye Name: 5-tert-butyl-2-(3-iodo-4-methyl-phenyl)pyrazol-3-amine CAS Name: 5-tert-butyl-2-(3-iodo-4-methylphenyl)-3-pyrazolamine IUPAC Name: 5-tert-butyl-2-(3-iodo-4-methylphenyl)pyrazol-3-amine Traditional Name: [5-tert-butyl-2-(3-iodo-4-methyl-phenyl)pyrazol-3-yl]amine Formula: C14H18IN3 MolecularWeight: 355.21729

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=CC(=N2)C(C)(C)C)N)I

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=CC(=N2)C(C)(C)C)N)I

InChI

InChI=1S/C14H18IN3/c1-9-5-6-10(7-11(9)15)18-13(16)8-12(17-18)14(2,3)4/h5-8H,16H2,1-4H3