4-[5-(2-ethoxyphenyl)-1H-1,2,4-triazol-3-yl]-2-phenethyl-pyrazol-3-amine

Systemtic Name: 4-[5-(2-ethoxyphenyl)-1H-1,2,4-triazol-3-yl]-2-phenethyl-pyrazol-3-amine Openeye Name: 4-[5-(2-ethoxyphenyl)-1H-1,2,4-triazol-3-yl]-2-phenethyl-pyrazol-3-amine CAS Name: 4-[5-(2-ethoxyphenyl)-1H-1,2,4-triazol-3-yl]-2-phenethyl-3-pyrazolamine IUPAC Name: 4-[5-(2-ethoxyphenyl)-1H-1,2,4-triazol-3-yl]-2-phenethylpyrazol-3-amine Traditional Name: [4-(5-o-phenetyl-1H-1,2,4-triazol-3-yl)-2-phenethyl-pyrazol-3-yl]amine Formula: C21H22N6O MolecularWeight: 374.43898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NC(=NN2)C3=C(N(N=C3)CCC4=CC=CC=C4)N

Isomeric SMILES

CCOC1=CC=CC=C1C2=NC(=NN2)C3=C(N(N=C3)CCC4=CC=CC=C4)N

InChI

InChI=1S/C21H22N6O/c1-2-28-18-11-7-6-10-16(18)20-24-21(26-25-20)17-14-23-27(19(17)22)13-12-15-8-4-3-5-9-15/h3-11,14H,2,12-13,22H2,1H3,(H,24,25,26)