N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]-3-(pyrimidin-2-ylamino)propanamide

Systemtic Name: N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]-3-(pyrimidin-2-ylamino)propanamide Openeye Name: N-[[6-(2,5-dimethylphenoxy)-3-pyridyl]methyl]-3-(pyrimidin-2-ylamino)propanamide CAS Name: N-[[6-(2,5-dimethylphenoxy)-3-pyridinyl]methyl]-3-(2-pyrimidinylamino)propanamide IUPAC Name: N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]-3-(pyrimidin-2-ylamino)propanamide Traditional Name: N-[[6-(2,5-dimethylphenoxy)-3-pyridyl]methyl]-3-(2-pyrimidylamino)propionamide Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=NC=C(C=C2)CNC(=O)CCNC3=NC=CC=N3

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=NC=C(C=C2)CNC(=O)CCNC3=NC=CC=N3

InChI

InChI=1S/C21H23N5O2/c1-15-4-5-16(2)18(12-15)28-20-7-6-17(14-26-20)13-25-19(27)8-11-24-21-22-9-3-10-23-21/h3-7,9-10,12,14H,8,11,13H2,1-2H3,(H,25,27)(H,22,23,24)