dimethyl 3-[4-(thiophen-2-ylsulfonylamino)pyrazol-1-yl]pentanedioate

Systemtic Name: dimethyl 3-[4-(thiophen-2-ylsulfonylamino)pyrazol-1-yl]pentanedioate Openeye Name: dimethyl 3-[4-(2-thienylsulfonylamino)pyrazol-1-yl]pentanedioate CAS Name: 3-[4-(thiophen-2-ylsulfonylamino)-1-pyrazolyl]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 3-[4-(thiophen-2-ylsulfonylamino)pyrazol-1-yl]pentanedioate Traditional Name: 3-[4-(2-thienylsulfonylamino)pyrazol-1-yl]glutaric acid dimethyl ester Formula: C14H17N3O6S2 MolecularWeight: 387.43128

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC(=O)OC)N1C=C(C=N1)NS(=O)(=O)C2=CC=CS2

Isomeric SMILES

COC(=O)CC(CC(=O)OC)N1C=C(C=N1)NS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C14H17N3O6S2/c1-22-12(18)6-11(7-13(19)23-2)17-9-10(8-15-17)16-25(20,21)14-4-3-5-24-14/h3-5,8-9,11,16H,6-7H2,1-2H3