N4-butyl-N5-(phenylmethyl)-3-(phenylsulfonylmethyl)-1,2-oxazole-4,5-dicarboxamide

Systemtic Name: N4-butyl-N5-(phenylmethyl)-3-(phenylsulfonylmethyl)-1,2-oxazole-4,5-dicarboxamide Openeye Name: 3-(benzenesulfonylmethyl)-N5-benzyl-N4-butyl-isoxazole-4,5-dicarboxamide CAS Name: 3-(benzenesulfonylmethyl)-N4-butyl-N5-(phenylmethyl)isoxazole-4,5-dicarboxamide IUPAC Name: 3-(benzenesulfonylmethyl)-5-N-benzyl-4-N-butyl-1,2-oxazole-4,5-dicarboxamide Traditional Name: N'-benzyl-3-(besylmethyl)-N-butyl-isoxazole-4,5-dicarboxamide Formula: C23H25N3O5S MolecularWeight: 455.5267

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(ON=C1CS(=O)(=O)C2=CC=CC=C2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)C1=C(ON=C1CS(=O)(=O)C2=CC=CC=C2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H25N3O5S/c1-2-3-14-24-22(27)20-19(16-32(29,30)18-12-8-5-9-13-18)26-31-21(20)23(28)25-15-17-10-6-4-7-11-17/h4-13H,2-3,14-16H2,1H3,(H,24,27)(H,25,28)