N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-methoxy-2,5-dimethyl-benzenesulfonamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-methoxy-2,5-dimethyl-benzenesulfonamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-methoxy-2,5-dimethyl-benzenesulfonamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-4-methoxy-2,5-dimethylbenzenesulfonamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-methoxy-2,5-dimethylbenzenesulfonamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-methoxy-2,5-dimethyl-benzenesulfonamide Formula: C21H30N4O4S MolecularWeight: 434.5523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1S(=O)(=O)NCCOC2=NC=NC(=C2)N3CCCCCC3)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1S(=O)(=O)NCCOC2=NC=NC(=C2)N3CCCCCC3)C)OC

InChI

InChI=1S/C21H30N4O4S/c1-16-13-19(17(2)12-18(16)28-3)30(26,27)24-8-11-29-21-14-20(22-15-23-21)25-9-6-4-5-7-10-25/h12-15,24H,4-11H2,1-3H3