3-[(4-methylphenyl)sulfonylmethyl]-N-(2-oxidanylpropyl)-1,2,4-oxadiazole-5-carboxamide

Systemtic Name: 3-[(4-methylphenyl)sulfonylmethyl]-N-(2-oxidanylpropyl)-1,2,4-oxadiazole-5-carboxamide Openeye Name: N-(2-hydroxypropyl)-3-(p-tolylsulfonylmethyl)-1,2,4-oxadiazole-5-carboxamide CAS Name: N-(2-hydroxypropyl)-3-[(4-methylphenyl)sulfonylmethyl]-1,2,4-oxadiazole-5-carboxamide IUPAC Name: N-(2-hydroxypropyl)-3-[(4-methylphenyl)sulfonylmethyl]-1,2,4-oxadiazole-5-carboxamide Traditional Name: N-(2-hydroxypropyl)-3-(tosylmethyl)-1,2,4-oxadiazole-5-carboxamide Formula: C14H17N3O5S MolecularWeight: 339.36688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=NOC(=N2)C(=O)NCC(C)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=NOC(=N2)C(=O)NCC(C)O

InChI

InChI=1S/C14H17N3O5S/c1-9-3-5-11(6-4-9)23(20,21)8-12-16-14(22-17-12)13(19)15-7-10(2)18/h3-6,10,18H,7-8H2,1-2H3,(H,15,19)