methyl 3-[(2-methoxyphenyl)carbonylamino]-5-[(1,2,5-thiadiazol-3-ylcarbonylamino)methyl]benzoate

Systemtic Name: methyl 3-[(2-methoxyphenyl)carbonylamino]-5-[(1,2,5-thiadiazol-3-ylcarbonylamino)methyl]benzoate Openeye Name: methyl 3-[(2-methoxybenzoyl)amino]-5-[(1,2,5-thiadiazole-3-carbonylamino)methyl]benzoate CAS Name: 3-[[(2-methoxyphenyl)-oxomethyl]amino]-5-[[[oxo(1,2,5-thiadiazol-3-yl)methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(2-methoxybenzoyl)amino]-5-[(1,2,5-thiadiazole-3-carbonylamino)methyl]benzoate Traditional Name: 3-(o-anisoylamino)-5-[(1,2,5-thiadiazole-3-carbonylamino)methyl]benzoic acid methyl ester Formula: C20H18N4O5S MolecularWeight: 426.44572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=CC(=CC(=C2)CNC(=O)C3=NSN=C3)C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=CC(=CC(=C2)CNC(=O)C3=NSN=C3)C(=O)OC

InChI

InChI=1S/C20H18N4O5S/c1-28-17-6-4-3-5-15(17)18(25)23-14-8-12(7-13(9-14)20(27)29-2)10-21-19(26)16-11-22-30-24-16/h3-9,11H,10H2,1-2H3,(H,21,26)(H,23,25)