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

Systemtic Name: N-[[3-ethyl-1-(3-methylphenyl)-5-(4-methylpiperazin-1-yl)pyrazol-4-yl]methyl]cyclopropanamine Openeye Name: N-[[3-ethyl-5-(4-methylpiperazin-1-yl)-1-(m-tolyl)pyrazol-4-yl]methyl]cyclopropanamine CAS Name: N-[[3-ethyl-1-(3-methylphenyl)-5-(4-methyl-1-piperazinyl)-4-pyrazolyl]methyl]cyclopropanamine IUPAC Name: N-[[3-ethyl-1-(3-methylphenyl)-5-(4-methylpiperazin-1-yl)pyrazol-4-yl]methyl]cyclopropanamine Traditional Name: cyclopropyl-[[3-ethyl-5-(4-methylpiperazino)-1-(m-tolyl)pyrazol-4-yl]methyl]amine Formula: C21H31N5 MolecularWeight: 353.50434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1CNC2CC2)N3CCN(CC3)C)C4=CC=CC(=C4)C

Isomeric SMILES

CCC1=NN(C(=C1CNC2CC2)N3CCN(CC3)C)C4=CC=CC(=C4)C

InChI

InChI=1S/C21H31N5/c1-4-20-19(15-22-17-8-9-17)21(25-12-10-24(3)11-13-25)26(23-20)18-7-5-6-16(2)14-18/h5-7,14,17,22H,4,8-13,15H2,1-3H3