5-(3-butan-2-yl-4-methoxy-phenyl)-4-iodanyl-1H-pyrazol-3-amine

Systemtic Name: 5-(3-butan-2-yl-4-methoxy-phenyl)-4-iodanyl-1H-pyrazol-3-amine Openeye Name: 4-iodo-5-(4-methoxy-3-sec-butyl-phenyl)-1H-pyrazol-3-amine CAS Name: 5-(3-butan-2-yl-4-methoxyphenyl)-4-iodo-1H-pyrazol-3-amine IUPAC Name: 5-(3-butan-2-yl-4-methoxyphenyl)-4-iodo-1H-pyrazol-3-amine Traditional Name: [4-iodo-5-(4-methoxy-3-sec-butyl-phenyl)-1H-pyrazol-3-yl]amine Formula: C14H18IN3O MolecularWeight: 371.21669

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(C=CC(=C1)C2=C(C(=NN2)N)I)OC

Isomeric SMILES

CCC(C)C1=C(C=CC(=C1)C2=C(C(=NN2)N)I)OC

InChI

InChI=1S/C14H18IN3O/c1-4-8(2)10-7-9(5-6-11(10)19-3)13-12(15)14(16)18-17-13/h5-8H,4H2,1-3H3,(H3,16,17,18)