(2S)-1-[5-methoxy-2-[[(4-pyrazol-1-ylphenyl)methylamino]methyl]phenoxy]-3-pyrrolidin-1-yl-propan-2-ol

Systemtic Name: (2S)-1-[5-methoxy-2-[[(4-pyrazol-1-ylphenyl)methylamino]methyl]phenoxy]-3-pyrrolidin-1-yl-propan-2-ol Openeye Name: (2S)-1-[5-methoxy-2-[[(4-pyrazol-1-ylphenyl)methylamino]methyl]phenoxy]-3-pyrrolidin-1-yl-propan-2-ol CAS Name: (2S)-1-[5-methoxy-2-[[[4-(1-pyrazolyl)phenyl]methylamino]methyl]phenoxy]-3-(1-pyrrolidinyl)-2-propanol IUPAC Name: (2S)-1-[5-methoxy-2-[[(4-pyrazol-1-ylphenyl)methylamino]methyl]phenoxy]-3-pyrrolidin-1-ylpropan-2-ol Traditional Name: (2S)-1-[5-methoxy-2-[[(4-pyrazol-1-ylbenzyl)amino]methyl]phenoxy]-3-pyrrolidino-propan-2-ol Formula: C25H32N4O3 MolecularWeight: 436.54658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNCC2=CC=C(C=C2)N3C=CC=N3)OCC(CN4CCCC4)O

Isomeric SMILES

COC1=CC(=C(C=C1)CNCC2=CC=C(C=C2)N3C=CC=N3)OC[C@H](CN4CCCC4)O

InChI

InChI=1S/C25H32N4O3/c1-31-24-10-7-21(25(15-24)32-19-23(30)18-28-12-2-3-13-28)17-26-16-20-5-8-22(9-6-20)29-14-4-11-27-29/h4-11,14-15,23,26,30H,2-3,12-13,16-19H2,1H3/t23-/m0/s1