dimethyl 3-[4-[(2-methoxycarbonylthiophen-3-yl)sulfonylamino]pyrazol-1-yl]pentanedioate

Systemtic Name: dimethyl 3-[4-[(2-methoxycarbonylthiophen-3-yl)sulfonylamino]pyrazol-1-yl]pentanedioate Openeye Name: dimethyl 3-[4-[(2-methoxycarbonyl-3-thienyl)sulfonylamino]pyrazol-1-yl]pentanedioate CAS Name: 3-[4-[(2-methoxycarbonyl-3-thiophenyl)sulfonylamino]-1-pyrazolyl]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 3-[4-[(2-methoxycarbonylthiophen-3-yl)sulfonylamino]pyrazol-1-yl]pentanedioate Traditional Name: 3-[4-[(2-carbomethoxy-3-thienyl)sulfonylamino]pyrazol-1-yl]glutaric acid dimethyl ester Formula: C16H19N3O8S2 MolecularWeight: 445.46736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O8S2/c1-25-13(20)6-11(7-14(21)26-2)19-9-10(8-17-19)18-29(23,24)12-4-5-28-15(12)16(22)27-3/h4-5,8-9,11,18H,6-7H2,1-3H3