1,3-benzothiazol-2-ylmethyl 4-(prop-2-ynylsulfamoyl)benzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 4-(prop-2-ynylsulfamoyl)benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 4-(prop-2-ynylsulfamoyl)benzoate CAS Name: 4-(prop-2-ynylsulfamoyl)benzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 4-(prop-2-ynylsulfamoyl)benzoate Traditional Name: 4-(propargylsulfamoyl)benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C18H14N2O4S2 MolecularWeight: 386.44476

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3S2

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H14N2O4S2/c1-2-11-19-26(22,23)14-9-7-13(8-10-14)18(21)24-12-17-20-15-5-3-4-6-16(15)25-17/h1,3-10,19H,11-12H2