N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-methoxy-2,3,5-trimethyl-benzenesulfonamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-methoxy-2,3,5-trimethyl-benzenesulfonamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-methoxy-2,3,5-trimethyl-benzenesulfonamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-4-methoxy-2,3,5-trimethylbenzenesulfonamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-methoxy-2,3,5-trimethylbenzenesulfonamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-methoxy-2,3,5-trimethyl-benzenesulfonamide Formula: C22H32N4O4S MolecularWeight: 448.57888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1OC)C)C)S(=O)(=O)NCCOC2=NC=NC(=C2)N3CCCCCC3

Isomeric SMILES

CC1=CC(=C(C(=C1OC)C)C)S(=O)(=O)NCCOC2=NC=NC(=C2)N3CCCCCC3

InChI

InChI=1S/C22H32N4O4S/c1-16-13-19(17(2)18(3)22(16)29-4)31(27,28)25-9-12-30-21-14-20(23-15-24-21)26-10-7-5-6-8-11-26/h13-15,25H,5-12H2,1-4H3