N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3-(3,5-dimethylphenoxy)propanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3-(3,5-dimethylphenoxy)propanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3-(3,5-dimethylphenoxy)propanamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-3-(3,5-dimethylphenoxy)propanamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-3-(3,5-dimethylphenoxy)propanamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3-(3,5-dimethylphenoxy)propionamide Formula: C24H32N2O5S MolecularWeight: 460.58628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC)C

InChI

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