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

Systemtic Name: N-[[3-ethyl-1-(4-fluorophenyl)-5-(4-methylpiperazin-1-yl)pyrazol-4-yl]methyl]-3-methyl-butan-1-amine Openeye Name: N-[[3-ethyl-1-(4-fluorophenyl)-5-(4-methylpiperazin-1-yl)pyrazol-4-yl]methyl]-3-methyl-butan-1-amine CAS Name: N-[[3-ethyl-1-(4-fluorophenyl)-5-(4-methyl-1-piperazinyl)-4-pyrazolyl]methyl]-3-methyl-1-butanamine IUPAC Name: N-[[3-ethyl-1-(4-fluorophenyl)-5-(4-methylpiperazin-1-yl)pyrazol-4-yl]methyl]-3-methylbutan-1-amine Traditional Name: [3-ethyl-1-(4-fluorophenyl)-5-(4-methylpiperazino)pyrazol-4-yl]methyl-isoamyl-amine Formula: C22H34FN5 MolecularWeight: 387.537263

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1CNCCC(C)C)N2CCN(CC2)C)C3=CC=C(C=C3)F

Isomeric SMILES

CCC1=NN(C(=C1CNCCC(C)C)N2CCN(CC2)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H34FN5/c1-5-21-20(16-24-11-10-17(2)3)22(27-14-12-26(4)13-15-27)28(25-21)19-8-6-18(23)7-9-19/h6-9,17,24H,5,10-16H2,1-4H3