4-iodanyl-5-(2-phenylmethoxy-5-propan-2-yl-phenyl)-1H-pyrazol-3-amine

Systemtic Name: 4-iodanyl-5-(2-phenylmethoxy-5-propan-2-yl-phenyl)-1H-pyrazol-3-amine Openeye Name: 5-(2-benzyloxy-5-isopropyl-phenyl)-4-iodo-1H-pyrazol-3-amine CAS Name: 4-iodo-5-(2-phenylmethoxy-5-propan-2-ylphenyl)-1H-pyrazol-3-amine IUPAC Name: 4-iodo-5-(2-phenylmethoxy-5-propan-2-ylphenyl)-1H-pyrazol-3-amine Traditional Name: [5-(2-benzoxy-5-isopropyl-phenyl)-4-iodo-1H-pyrazol-3-yl]amine Formula: C19H20IN3O MolecularWeight: 433.28607

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=C(C(=NN3)N)I

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=C(C(=NN3)N)I

InChI

InChI=1S/C19H20IN3O/c1-12(2)14-8-9-16(24-11-13-6-4-3-5-7-13)15(10-14)18-17(20)19(21)23-22-18/h3-10,12H,11H2,1-2H3,(H3,21,22,23)