[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-(phenylsulfonylamino)propanoate

Systemtic Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-(phenylsulfonylamino)propanoate Openeye Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-(benzenesulfonamido)propanoate CAS Name: 3-(benzenesulfonamido)propanoic acid [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-(benzenesulfonamido)propanoate Traditional Name: 3-(benzenesulfonamido)propionic acid [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)CCNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)CCNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O5S/c1-2-15-8-10-16(11-9-15)20-22-18(28-23-20)14-27-19(24)12-13-21-29(25,26)17-6-4-3-5-7-17/h3-11,21H,2,12-14H2,1H3