ethyl 2-[2-(4-methylphenyl)sulfonylethanoylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[2-(4-methylphenyl)sulfonylethanoylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[[2-(p-tolylsulfonyl)acetyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[2-(4-methylphenyl)sulfonyl-1-oxoethyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-methylphenyl)sulfonylacetyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(2-tosylacetyl)amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C19H18N2O5S2 MolecularWeight: 418.48662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H18N2O5S2/c1-3-26-18(23)13-6-9-15-16(10-13)27-19(20-15)21-17(22)11-28(24,25)14-7-4-12(2)5-8-14/h4-10H,3,11H2,1-2H3,(H,20,21,22)