2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-[4-ethoxy-3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-[4-ethoxy-3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-(4-ethoxy-3-piperidinosulfonyl-phenyl)acetamide Formula: C21H29N3O5S2 MolecularWeight: 467.60206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CSCC2=C(ON=C2C)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CSCC2=C(ON=C2C)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H29N3O5S2/c1-4-28-19-9-8-17(12-20(19)31(26,27)24-10-6-5-7-11-24)22-21(25)14-30-13-18-15(2)23-29-16(18)3/h8-9,12H,4-7,10-11,13-14H2,1-3H3,(H,22,25)