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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(3,5-dimethylisoxazol-4-yl)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-(3,5-dimethyl-4-isoxazolyl)acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(3,5-dimethylisoxazol-4-yl)acetamide Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CC2=C(ON=C2C)C)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CC2=C(ON=C2C)C)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H27N3O4S/c1-14-8-9-17(21-20(24)13-18-15(2)22-27-16(18)3)12-19(14)28(25,26)23-10-6-4-5-7-11-23/h8-9,12H,4-7,10-11,13H2,1-3H3,(H,21,24)