ethyl 5-[(2-methoxy-2-oxidanylidene-ethyl)sulfamoyl]-1-(phenylmethyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(2-methoxy-2-oxidanylidene-ethyl)sulfamoyl]-1-(phenylmethyl)pyrazole-4-carboxylate Openeye Name: ethyl 1-benzyl-5-[(2-methoxy-2-oxo-ethyl)sulfamoyl]pyrazole-4-carboxylate CAS Name: 5-[(2-methoxy-2-oxoethyl)sulfamoyl]-1-(phenylmethyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-5-[(2-methoxy-2-oxoethyl)sulfamoyl]pyrazole-4-carboxylate Traditional Name: 1-benzyl-5-[(2-keto-2-methoxy-ethyl)sulfamoyl]pyrazole-4-carboxylic acid ethyl ester Formula: C16H19N3O6S MolecularWeight: 381.40356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)CC2=CC=CC=C2)S(=O)(=O)NCC(=O)OC

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)CC2=CC=CC=C2)S(=O)(=O)NCC(=O)OC

InChI

InChI=1S/C16H19N3O6S/c1-3-25-16(21)13-9-17-19(11-12-7-5-4-6-8-12)15(13)26(22,23)18-10-14(20)24-2/h4-9,18H,3,10-11H2,1-2H3