2-(2,5-dimethylphenoxy)-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]propanamide

Systemtic Name: 2-(2,5-dimethylphenoxy)-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]propanamide Openeye Name: 2-(2,5-dimethylphenoxy)-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]propanamide CAS Name: 2-(2,5-dimethylphenoxy)-N-[2-[[6-(1-pyrrolidinyl)-4-pyrimidinyl]oxy]ethyl]propanamide IUPAC Name: 2-(2,5-dimethylphenoxy)-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]propanamide Traditional Name: 2-(2,5-dimethylphenoxy)-N-[2-(6-pyrrolidinopyrimidin-4-yl)oxyethyl]propionamide Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC(C)C(=O)NCCOC2=NC=NC(=C2)N3CCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC(C)C(=O)NCCOC2=NC=NC(=C2)N3CCCC3

InChI

InChI=1S/C21H28N4O3/c1-15-6-7-16(2)18(12-15)28-17(3)21(26)22-8-11-27-20-13-19(23-14-24-20)25-9-4-5-10-25/h6-7,12-14,17H,4-5,8-11H2,1-3H3,(H,22,26)