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

Systemtic Name: N-[[3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl]-1-(1H-1,2,4-triazol-5-yl)ethanamine Openeye Name: N-[[3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl]-1-(1H-1,2,4-triazol-5-yl)ethanamine CAS Name: N-[[3-(4-cyclohexylphenyl)-1-methyl-4-pyrazolyl]methyl]-1-(1H-1,2,4-triazol-5-yl)ethanamine IUPAC Name: N-[[3-(4-cyclohexylphenyl)-1-methylpyrazol-4-yl]methyl]-1-(1H-1,2,4-triazol-5-yl)ethanamine Traditional Name: [3-(4-cyclohexylphenyl)-1-methyl-pyrazol-4-yl]methyl-[1-(1H-1,2,4-triazol-5-yl)ethyl]amine Formula: C21H28N6 MolecularWeight: 364.48722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=NN1)NCC2=CN(N=C2C3=CC=C(C=C3)C4CCCCC4)C

Isomeric SMILES

CC(C1=NC=NN1)NCC2=CN(N=C2C3=CC=C(C=C3)C4CCCCC4)C

InChI

InChI=1S/C21H28N6/c1-15(21-23-14-24-25-21)22-12-19-13-27(2)26-20(19)18-10-8-17(9-11-18)16-6-4-3-5-7-16/h8-11,13-16,22H,3-7,12H2,1-2H3,(H,23,24,25)