methyl 3-(thiomorpholin-4-ylcarbonylamino)benzoate

Systemtic Name: methyl 3-(thiomorpholin-4-ylcarbonylamino)benzoate Openeye Name: methyl 3-(thiomorpholine-4-carbonylamino)benzoate CAS Name: 3-[[oxo(thiomorpholin-4-yl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-(thiomorpholine-4-carbonylamino)benzoate Traditional Name: 3-(thiomorpholine-4-carbonylamino)benzoic acid methyl ester Formula: C13H16N2O3S MolecularWeight: 280.34274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)N2CCSCC2

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)N2CCSCC2

InChI

InChI=1S/C13H16N2O3S/c1-18-12(16)10-3-2-4-11(9-10)14-13(17)15-5-7-19-8-6-15/h2-4,9H,5-8H2,1H3,(H,14,17)