ethyl 5-[1,3-benzothiazol-2-ylmethyl(methyl)sulfamoyl]-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[1,3-benzothiazol-2-ylmethyl(methyl)sulfamoyl]-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-[1,3-benzothiazol-2-ylmethyl(methyl)sulfamoyl]-1H-pyrazole-4-carboxylate CAS Name: 5-[1,3-benzothiazol-2-ylmethyl(methyl)sulfamoyl]-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[1,3-benzothiazol-2-ylmethyl(methyl)sulfamoyl]-1H-pyrazole-4-carboxylate Traditional Name: 5-[1,3-benzothiazol-2-ylmethyl(methyl)sulfamoyl]-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C15H16N4O4S2 MolecularWeight: 380.44194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1)S(=O)(=O)N(C)CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC(=O)C1=C(NN=C1)S(=O)(=O)N(C)CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C15H16N4O4S2/c1-3-23-15(20)10-8-16-18-14(10)25(21,22)19(2)9-13-17-11-6-4-5-7-12(11)24-13/h4-8H,3,9H2,1-2H3,(H,16,18)