butyl 2-(phenylsulfonylamino)-1,3-benzothiazole-6-carboxylate

Systemtic Name: butyl 2-(phenylsulfonylamino)-1,3-benzothiazole-6-carboxylate Openeye Name: butyl 2-(benzenesulfonamido)-1,3-benzothiazole-6-carboxylate CAS Name: 2-(benzenesulfonamido)-1,3-benzothiazole-6-carboxylic acid butyl ester IUPAC Name: butyl 2-(benzenesulfonamido)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(benzenesulfonamido)-1,3-benzothiazole-6-carboxylic acid butyl ester Formula: C18H18N2O4S2 MolecularWeight: 390.47652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H18N2O4S2/c1-2-3-11-24-17(21)13-9-10-15-16(12-13)25-18(19-15)20-26(22,23)14-7-5-4-6-8-14/h4-10,12H,2-3,11H2,1H3,(H,19,20)