N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(2-chloranylphenoxy)ethanamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(2-chloranylphenoxy)ethanamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(2-chlorophenoxy)acetamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-2-(2-chlorophenoxy)acetamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(2-chlorophenoxy)acetamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(2-chlorophenoxy)acetamide Formula: C20H25ClN4O3 MolecularWeight: 404.8905

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC(=NC=N2)OCCNC(=O)COC3=CC=CC=C3Cl

Isomeric SMILES

C1CCCN(CC1)C2=CC(=NC=N2)OCCNC(=O)COC3=CC=CC=C3Cl

InChI

InChI=1S/C20H25ClN4O3/c21-16-7-3-4-8-17(16)28-14-19(26)22-9-12-27-20-13-18(23-15-24-20)25-10-5-1-2-6-11-25/h3-4,7-8,13,15H,1-2,5-6,9-12,14H2,(H,22,26)