ethyl 2-(2-propanoylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: ethyl 2-(2-propanoylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)ethanoate Openeye Name: ethyl 2-(2-propanoylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)acetate CAS Name: 2-[2-(1-oxopropylimino)-6-sulfamoyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-(2-propanoylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(2-propionylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)acetic acid ethyl ester Formula: C14H17N3O5S2 MolecularWeight: 371.43188

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N=C1N(C2=C(S1)C=C(C=C2)S(=O)(=O)N)CC(=O)OCC

Isomeric SMILES

CCC(=O)N=C1N(C2=C(S1)C=C(C=C2)S(=O)(=O)N)CC(=O)OCC

InChI

InChI=1S/C14H17N3O5S2/c1-3-12(18)16-14-17(8-13(19)22-4-2)10-6-5-9(24(15,20)21)7-11(10)23-14/h5-7H,3-4,8H2,1-2H3,(H2,15,20,21)