N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(4-chloranyl-3-methyl-phenoxy)ethanamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(4-chloranyl-3-methyl-phenoxy)ethanamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(4-chloro-3-methyl-phenoxy)acetamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-2-(4-chloro-3-methylphenoxy)acetamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(4-chloro-3-methylphenoxy)acetamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(4-chloro-3-methyl-phenoxy)acetamide Formula: C21H27ClN4O3 MolecularWeight: 418.91708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NCCOC2=NC=NC(=C2)N3CCCCCC3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NCCOC2=NC=NC(=C2)N3CCCCCC3)Cl

InChI

InChI=1S/C21H27ClN4O3/c1-16-12-17(6-7-18(16)22)29-14-20(27)23-8-11-28-21-13-19(24-15-25-21)26-9-4-2-3-5-10-26/h6-7,12-13,15H,2-5,8-11,14H2,1H3,(H,23,27)