ethyl 5-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]-1H-pyrazole-4-carboxylate CAS Name: 5-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]-1H-pyrazole-4-carboxylate Traditional Name: 5-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C16H21N3O5S MolecularWeight: 367.42004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1)NS(=O)(=O)C2=C(C(=C(C=C2C)OC)C)C

Isomeric SMILES

CCOC(=O)C1=C(NN=C1)NS(=O)(=O)C2=C(C(=C(C=C2C)OC)C)C

InChI

InChI=1S/C16H21N3O5S/c1-6-24-16(20)12-8-17-18-15(12)19-25(21,22)14-9(2)7-13(23-5)10(3)11(14)4/h7-8H,6H2,1-5H3,(H2,17,18,19)