N-[[3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl]-2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethanamine

Systemtic Name: N-[[3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl]-2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethanamine Openeye Name: N-[[3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl]-2-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]ethanamine CAS Name: N-[[3-(4-cyclohexylphenyl)-1-methyl-4-pyrazolyl]methyl]-2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethanamine IUPAC Name: N-[[3-(4-cyclohexylphenyl)-1-methylpyrazol-4-yl]methyl]-2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethanamine Traditional Name: [3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl-[2-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]ethyl]amine Formula: C26H31N7 MolecularWeight: 441.57124

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=C(C=C2)C3CCCCC3)CNCCC4=NC(=NN4)C5=CC=NC=C5

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=C(C=C2)C3CCCCC3)CNCCC4=NC(=NN4)C5=CC=NC=C5

InChI

InChI=1S/C26H31N7/c1-33-18-23(17-28-16-13-24-29-26(31-30-24)22-11-14-27-15-12-22)25(32-33)21-9-7-20(8-10-21)19-5-3-2-4-6-19/h7-12,14-15,18-19,28H,2-6,13,16-17H2,1H3,(H,29,30,31)