methyl 4-[5-(thiomorpholin-4-ylmethyl)-1,2,4-oxadiazol-3-yl]benzoate

Systemtic Name: methyl 4-[5-(thiomorpholin-4-ylmethyl)-1,2,4-oxadiazol-3-yl]benzoate Openeye Name: methyl 4-[5-(thiomorpholinomethyl)-1,2,4-oxadiazol-3-yl]benzoate CAS Name: 4-[5-(thiomorpholin-4-ylmethyl)-1,2,4-oxadiazol-3-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-(thiomorpholin-4-ylmethyl)-1,2,4-oxadiazol-3-yl]benzoate Traditional Name: 4-[5-(thiomorpholinomethyl)-1,2,4-oxadiazol-3-yl]benzoic acid methyl ester Formula: C15H17N3O3S MolecularWeight: 319.37878

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=NOC(=N2)CN3CCSCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=NOC(=N2)CN3CCSCC3

InChI

InChI=1S/C15H17N3O3S/c1-20-15(19)12-4-2-11(3-5-12)14-16-13(21-17-14)10-18-6-8-22-9-7-18/h2-5H,6-10H2,1H3