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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H32N4O3/c1-17-8-9-20(14-18(17)2)30-19(3)23(28)24-10-13-29-22-15-21(25-16-26-22)27-11-6-4-5-7-12-27/h8-9,14-16,19H,4-7,10-13H2,1-3H3,(H,24,28)