N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3-phenyl-propanamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3-phenyl-propanamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3-phenyl-propanamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-3-phenylpropanamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3-phenylpropanamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3-phenyl-propionamide Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC(=NC=N2)OCCNC(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C2=CC(=NC=N2)OCCNC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C21H28N4O2/c26-20(11-10-18-8-4-3-5-9-18)22-12-15-27-21-16-19(23-17-24-21)25-13-6-1-2-7-14-25/h3-5,8-9,16-17H,1-2,6-7,10-15H2,(H,22,26)