N-[[1-(3-chlorophenyl)-5-(4-methylpiperazin-1-yl)-3-propyl-pyrazol-4-yl]methyl]-2-methyl-propan-1-amine

Systemtic Name: N-[[1-(3-chlorophenyl)-5-(4-methylpiperazin-1-yl)-3-propyl-pyrazol-4-yl]methyl]-2-methyl-propan-1-amine Openeye Name: N-[[1-(3-chlorophenyl)-5-(4-methylpiperazin-1-yl)-3-propyl-pyrazol-4-yl]methyl]-2-methyl-propan-1-amine CAS Name: N-[[1-(3-chlorophenyl)-5-(4-methyl-1-piperazinyl)-3-propyl-4-pyrazolyl]methyl]-2-methyl-1-propanamine IUPAC Name: N-[[1-(3-chlorophenyl)-5-(4-methylpiperazin-1-yl)-3-propylpyrazol-4-yl]methyl]-2-methylpropan-1-amine Traditional Name: [1-(3-chlorophenyl)-5-(4-methylpiperazino)-3-propyl-pyrazol-4-yl]methyl-isobutyl-amine Formula: C22H34ClN5 MolecularWeight: 403.99186

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1CNCC(C)C)N2CCN(CC2)C)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCCC1=NN(C(=C1CNCC(C)C)N2CCN(CC2)C)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H34ClN5/c1-5-7-21-20(16-24-15-17(2)3)22(27-12-10-26(4)11-13-27)28(25-21)19-9-6-8-18(23)14-19/h6,8-9,14,17,24H,5,7,10-13,15-16H2,1-4H3