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

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-phenyl-ethanesulfonamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-phenyl-ethanesulfonamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-2-phenylethanesulfonamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-phenylethanesulfonamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-phenyl-ethanesulfonamide Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N4O3S/c25-28(26,15-10-18-8-4-3-5-9-18)23-11-14-27-20-16-19(21-17-22-20)24-12-6-1-2-7-13-24/h3-5,8-9,16-17,23H,1-2,6-7,10-15H2