2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-[(5-methyl-1-phenyl-pyrazol-3-yl)methyl]propan-1-amine

Systemtic Name: 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-[(5-methyl-1-phenyl-pyrazol-3-yl)methyl]propan-1-amine Openeye Name: 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-[(5-methyl-1-phenyl-pyrazol-3-yl)methyl]propan-1-amine CAS Name: 2-[4-(2,3-dimethylphenyl)-1-piperazinyl]-N-[(5-methyl-1-phenyl-3-pyrazolyl)methyl]-1-propanamine IUPAC Name: 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-[(5-methyl-1-phenylpyrazol-3-yl)methyl]propan-1-amine Traditional Name: 2-[4-(2,3-dimethylphenyl)piperazino]propyl-[(5-methyl-1-phenyl-pyrazol-3-yl)methyl]amine Formula: C26H35N5 MolecularWeight: 417.5896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(C)CNCC3=NN(C(=C3)C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(C)CNCC3=NN(C(=C3)C)C4=CC=CC=C4)C

InChI

InChI=1S/C26H35N5/c1-20-9-8-12-26(23(20)4)30-15-13-29(14-16-30)22(3)18-27-19-24-17-21(2)31(28-24)25-10-6-5-7-11-25/h5-12,17,22,27H,13-16,18-19H2,1-4H3