N-[[3-ethyl-1-(2-methylphenyl)-5-(4-methylpiperazin-1-yl)pyrazol-4-yl]methyl]butan-2-amine

Systemtic Name: N-[[3-ethyl-1-(2-methylphenyl)-5-(4-methylpiperazin-1-yl)pyrazol-4-yl]methyl]butan-2-amine Openeye Name: N-[[3-ethyl-5-(4-methylpiperazin-1-yl)-1-(o-tolyl)pyrazol-4-yl]methyl]butan-2-amine CAS Name: N-[[3-ethyl-1-(2-methylphenyl)-5-(4-methyl-1-piperazinyl)-4-pyrazolyl]methyl]-2-butanamine IUPAC Name: N-[[3-ethyl-1-(2-methylphenyl)-5-(4-methylpiperazin-1-yl)pyrazol-4-yl]methyl]butan-2-amine Traditional Name: [3-ethyl-5-(4-methylpiperazino)-1-(o-tolyl)pyrazol-4-yl]methyl-sec-butyl-amine Formula: C22H35N5 MolecularWeight: 369.5468

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1CNC(C)CC)N2CCN(CC2)C)C3=CC=CC=C3C

Isomeric SMILES

CCC1=NN(C(=C1CNC(C)CC)N2CCN(CC2)C)C3=CC=CC=C3C

InChI

InChI=1S/C22H35N5/c1-6-18(4)23-16-19-20(7-2)24-27(21-11-9-8-10-17(21)3)22(19)26-14-12-25(5)13-15-26/h8-11,18,23H,6-7,12-16H2,1-5H3