N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(3,5-dimethylisoxazol-4-yl)acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-(3,5-dimethyl-4-isoxazolyl)acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(3,5-dimethylisoxazol-4-yl)acetamide Formula: C20H27N3O5S MolecularWeight: 421.51048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CC1=C(C(=NO1)C)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C20H27N3O5S/c1-14-17(15(2)28-22-14)13-20(24)21-18-12-16(8-9-19(18)27-3)29(25,26)23-10-6-4-5-7-11-23/h8-9,12H,4-7,10-11,13H2,1-3H3,(H,21,24)