4-[2-(4-methoxyphenyl)ethynyl]-1-methyl-pyrazol-3-amine

Systemtic Name: 4-[2-(4-methoxyphenyl)ethynyl]-1-methyl-pyrazol-3-amine Openeye Name: 4-[2-(4-methoxyphenyl)ethynyl]-1-methyl-pyrazol-3-amine CAS Name: 4-[2-(4-methoxyphenyl)ethynyl]-1-methyl-3-pyrazolamine IUPAC Name: 4-[2-(4-methoxyphenyl)ethynyl]-1-methylpyrazol-3-amine Traditional Name: [4-[2-(4-methoxyphenyl)ethynyl]-1-methyl-pyrazol-3-yl]amine Formula: C13H13N3O MolecularWeight: 227.26182

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)N)C#CC2=CC=C(C=C2)OC

Isomeric SMILES

CN1C=C(C(=N1)N)C#CC2=CC=C(C=C2)OC

InChI

InChI=1S/C13H13N3O/c1-16-9-11(13(14)15-16)6-3-10-4-7-12(17-2)8-5-10/h4-5,7-9H,1-2H3,(H2,14,15)