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

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-1-phenyl-methanesulfonamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-1-phenyl-methanesulfonamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-1-phenylmethanesulfonamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-1-phenylmethanesulfonamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-1-phenyl-methanesulfonamide Formula: C19H26N4O3S MolecularWeight: 390.49974

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC(=NC=N2)OCCNS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C2=CC(=NC=N2)OCCNS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C19H26N4O3S/c24-27(25,15-17-8-4-3-5-9-17)22-10-13-26-19-14-18(20-16-21-19)23-11-6-1-2-7-12-23/h3-5,8-9,14,16,22H,1-2,6-7,10-13,15H2