1-[3-(2-azanylpyrimidin-4-yl)phenoxy]-3-[4-(3-chlorophenyl)piperazin-1-yl]propan-2-ol

Systemtic Name: 1-[3-(2-azanylpyrimidin-4-yl)phenoxy]-3-[4-(3-chlorophenyl)piperazin-1-yl]propan-2-ol Openeye Name: 1-[3-(2-aminopyrimidin-4-yl)phenoxy]-3-[4-(3-chlorophenyl)piperazin-1-yl]propan-2-ol CAS Name: 1-[3-(2-amino-4-pyrimidinyl)phenoxy]-3-[4-(3-chlorophenyl)-1-piperazinyl]-2-propanol IUPAC Name: 1-[3-(2-aminopyrimidin-4-yl)phenoxy]-3-[4-(3-chlorophenyl)piperazin-1-yl]propan-2-ol Traditional Name: 1-[3-(2-aminopyrimidin-4-yl)phenoxy]-3-[4-(3-chlorophenyl)piperazino]propan-2-ol Formula: C23H26ClN5O2 MolecularWeight: 439.93784

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=CC(=C2)C3=NC(=NC=C3)N)O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=CC(=C2)C3=NC(=NC=C3)N)O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H26ClN5O2/c24-18-4-2-5-19(14-18)29-11-9-28(10-12-29)15-20(30)16-31-21-6-1-3-17(13-21)22-7-8-26-23(25)27-22/h1-8,13-14,20,30H,9-12,15-16H2,(H2,25,26,27)