3-(azepan-1-ylcarbonyl)-4-methoxy-N-[(3-propan-2-yloxyphenyl)methyl]benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-4-methoxy-N-[(3-propan-2-yloxyphenyl)methyl]benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-N-[(3-isopropoxyphenyl)methyl]-4-methoxy-benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-4-methoxy-N-[(3-propan-2-yloxyphenyl)methyl]benzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-4-methoxy-N-[(3-propan-2-yloxyphenyl)methyl]benzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-N-(3-isopropoxybenzyl)-4-methoxy-benzenesulfonamide Formula: C24H32N2O5S MolecularWeight: 460.58628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)CNS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCCC3

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)CNS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCCC3

InChI

InChI=1S/C24H32N2O5S/c1-18(2)31-20-10-8-9-19(15-20)17-25-32(28,29)21-11-12-23(30-3)22(16-21)24(27)26-13-6-4-5-7-14-26/h8-12,15-16,18,25H,4-7,13-14,17H2,1-3H3