ethyl 2-[4-(dibutylsulfamoyl)phenyl]carbonylimino-3-ethyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[4-(dibutylsulfamoyl)phenyl]carbonylimino-3-ethyl-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[4-(dibutylsulfamoyl)benzoyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[4-(dibutylsulfamoyl)phenyl]-oxomethyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-(dibutylsulfamoyl)benzoyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[4-(dibutylsulfamoyl)benzoyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C27H35N3O5S2 MolecularWeight: 545.7139

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)C(=O)OCC)CC

Isomeric SMILES

CCCCN(CCCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)C(=O)OCC)CC

InChI

InChI=1S/C27H35N3O5S2/c1-5-9-17-29(18-10-6-2)37(33,34)22-14-11-20(12-15-22)25(31)28-27-30(7-3)23-16-13-21(19-24(23)36-27)26(32)35-8-4/h11-16,19H,5-10,17-18H2,1-4H3