(2S)-1-(4-ethylpiperazin-1-yl)-3-[3-[(3-pyrazol-1-ylpropylamino)methyl]phenoxy]propan-2-ol

Systemtic Name: (2S)-1-(4-ethylpiperazin-1-yl)-3-[3-[(3-pyrazol-1-ylpropylamino)methyl]phenoxy]propan-2-ol Openeye Name: (2S)-1-(4-ethylpiperazin-1-yl)-3-[3-[(3-pyrazol-1-ylpropylamino)methyl]phenoxy]propan-2-ol CAS Name: (2S)-1-(4-ethyl-1-piperazinyl)-3-[3-[[3-(1-pyrazolyl)propylamino]methyl]phenoxy]-2-propanol IUPAC Name: (2S)-1-(4-ethylpiperazin-1-yl)-3-[3-[(3-pyrazol-1-ylpropylamino)methyl]phenoxy]propan-2-ol Traditional Name: (2S)-1-(4-ethylpiperazino)-3-[3-[(3-pyrazol-1-ylpropylamino)methyl]phenoxy]propan-2-ol Formula: C22H35N5O2 MolecularWeight: 401.5456

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC(COC2=CC=CC(=C2)CNCCCN3C=CC=N3)O

Isomeric SMILES

CCN1CCN(CC1)C[C@@H](COC2=CC=CC(=C2)CNCCCN3C=CC=N3)O

InChI

InChI=1S/C22H35N5O2/c1-2-25-12-14-26(15-13-25)18-21(28)19-29-22-7-3-6-20(16-22)17-23-8-4-10-27-11-5-9-24-27/h3,5-7,9,11,16,21,23,28H,2,4,8,10,12-15,17-19H2,1H3/t21-/m0/s1