methyl 3-ethyl-2-[3-(4-methoxyphenyl)sulfonylpropanoylimino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 3-ethyl-2-[3-(4-methoxyphenyl)sulfonylpropanoylimino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 3-ethyl-2-[3-(4-methoxyphenyl)sulfonylpropanoylimino]-1,3-benzothiazole-6-carboxylate CAS Name: 3-ethyl-2-[3-(4-methoxyphenyl)sulfonyl-1-oxopropyl]imino-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-ethyl-2-[3-(4-methoxyphenyl)sulfonylpropanoylimino]-1,3-benzothiazole-6-carboxylate Traditional Name: 3-ethyl-2-[3-(4-methoxyphenyl)sulfonylpropanoylimino]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C21H22N2O6S2 MolecularWeight: 462.53918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N2O6S2/c1-4-23-17-10-5-14(20(25)29-3)13-18(17)30-21(23)22-19(24)11-12-31(26,27)16-8-6-15(28-2)7-9-16/h5-10,13H,4,11-12H2,1-3H3