1-[[3-methyl-5-[(E)-2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazol-4-yl]sulfonyl]-N-phenethyl-piperidine-4-carboxamide

Systemtic Name: 1-[[3-methyl-5-[(E)-2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazol-4-yl]sulfonyl]-N-phenethyl-piperidine-4-carboxamide Openeye Name: 1-[3-methyl-5-[(E)-2-(2,4,6-trimethylphenyl)vinyl]isoxazol-4-yl]sulfonyl-N-phenethyl-piperidine-4-carboxamide CAS Name: 1-[[3-methyl-5-[(E)-2-(2,4,6-trimethylphenyl)ethenyl]-4-isoxazolyl]sulfonyl]-N-phenethyl-4-piperidinecarboxamide IUPAC Name: 1-[[3-methyl-5-[(E)-2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazol-4-yl]sulfonyl]-N-phenethylpiperidine-4-carboxamide Traditional Name: 1-[5-[(E)-2-mesitylvinyl]-3-methyl-isoxazol-4-yl]sulfonyl-N-phenethyl-isonipecotamide Formula: C29H35N3O4S MolecularWeight: 521.6709

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C=CC2=C(C(=NO2)C)S(=O)(=O)N3CCC(CC3)C(=O)NCCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)/C=C/C2=C(C(=NO2)C)S(=O)(=O)N3CCC(CC3)C(=O)NCCC4=CC=CC=C4)C

InChI

InChI=1S/C29H35N3O4S/c1-20-18-21(2)26(22(3)19-20)10-11-27-28(23(4)31-36-27)37(34,35)32-16-13-25(14-17-32)29(33)30-15-12-24-8-6-5-7-9-24/h5-11,18-19,25H,12-17H2,1-4H3,(H,30,33)/b11-10+