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

Systemtic Name: methyl 2-[4-(dibutylsulfamoyl)phenyl]carbonylimino-3-methyl-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[4-(dibutylsulfamoyl)benzoyl]imino-3-methyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[4-(dibutylsulfamoyl)phenyl]-oxomethyl]imino-3-methyl-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[4-(dibutylsulfamoyl)benzoyl]imino-3-methyl-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[4-(dibutylsulfamoyl)benzoyl]imino-3-methyl-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C25H31N3O5S2 MolecularWeight: 517.66074

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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)OC)C

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)OC)C

InChI

InChI=1S/C25H31N3O5S2/c1-5-7-15-28(16-8-6-2)35(31,32)20-12-9-18(10-13-20)23(29)26-25-27(3)21-14-11-19(24(30)33-4)17-22(21)34-25/h9-14,17H,5-8,15-16H2,1-4H3