3-[(3,5-dimethylphenyl)sulfonylmethyl]-N4,N5-bis(phenylmethyl)-1,2-oxazole-4,5-dicarboxamide

Systemtic Name: 3-[(3,5-dimethylphenyl)sulfonylmethyl]-N4,N5-bis(phenylmethyl)-1,2-oxazole-4,5-dicarboxamide Openeye Name: N4,N5-dibenzyl-3-[(3,5-dimethylphenyl)sulfonylmethyl]isoxazole-4,5-dicarboxamide CAS Name: 3-[(3,5-dimethylphenyl)sulfonylmethyl]-N4,N5-bis(phenylmethyl)isoxazole-4,5-dicarboxamide IUPAC Name: 4-N,5-N-dibenzyl-3-[(3,5-dimethylphenyl)sulfonylmethyl]-1,2-oxazole-4,5-dicarboxamide Traditional Name: N,N'-dibenzyl-3-[(3,5-dimethylphenyl)sulfonylmethyl]isoxazole-4,5-dicarboxamide Formula: C28H27N3O5S MolecularWeight: 517.59608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)S(=O)(=O)CC2=NOC(=C2C(=O)NCC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)S(=O)(=O)CC2=NOC(=C2C(=O)NCC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4)C

InChI

InChI=1S/C28H27N3O5S/c1-19-13-20(2)15-23(14-19)37(34,35)18-24-25(27(32)29-16-21-9-5-3-6-10-21)26(36-31-24)28(33)30-17-22-11-7-4-8-12-22/h3-15H,16-18H2,1-2H3,(H,29,32)(H,30,33)