N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(3,5-dimethylphenoxy)propanamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(3,5-dimethylphenoxy)propanamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(3,5-dimethylphenoxy)propanamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-2-(3,5-dimethylphenoxy)propanamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(3,5-dimethylphenoxy)propanamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-(3,5-dimethylphenoxy)propionamide Formula: C23H32N4O3 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H32N4O3/c1-17-12-18(2)14-20(13-17)30-19(3)23(28)24-8-11-29-22-15-21(25-16-26-22)27-9-6-4-5-7-10-27/h12-16,19H,4-11H2,1-3H3,(H,24,28)