5-cyclopropyl-4-[[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]methyl]-2-(phenylmethyl)pyrazol-3-amine

Systemtic Name: 5-cyclopropyl-4-[[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]methyl]-2-(phenylmethyl)pyrazol-3-amine Openeye Name: 2-benzyl-5-cyclopropyl-4-[[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]methyl]pyrazol-3-amine CAS Name: 5-cyclopropyl-4-[[4-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-piperazinyl]methyl]-2-(phenylmethyl)-3-pyrazolamine IUPAC Name: 2-benzyl-5-cyclopropyl-4-[[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]methyl]pyrazol-3-amine Traditional Name: [2-benzyl-5-cyclopropyl-4-[[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazino]methyl]pyrazol-3-yl]amine Formula: C26H31N5O2 MolecularWeight: 445.55664

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN(C(=C2CN3CCN(CC3)C4=C5C(=CC=C4)OCCO5)N)CC6=CC=CC=C6

Isomeric SMILES

C1CC1C2=NN(C(=C2CN3CCN(CC3)C4=C5C(=CC=C4)OCCO5)N)CC6=CC=CC=C6

InChI

InChI=1S/C26H31N5O2/c27-26-21(24(20-9-10-20)28-31(26)17-19-5-2-1-3-6-19)18-29-11-13-30(14-12-29)22-7-4-8-23-25(22)33-16-15-32-23/h1-8,20H,9-18,27H2