ethyl 3-[[5-(4,5-dimethyl-1H-pyrazol-3-yl)thiophen-2-yl]sulfonylamino]benzoate

Systemtic Name: ethyl 3-[[5-(4,5-dimethyl-1H-pyrazol-3-yl)thiophen-2-yl]sulfonylamino]benzoate Openeye Name: ethyl 3-[[5-(4,5-dimethyl-1H-pyrazol-3-yl)-2-thienyl]sulfonylamino]benzoate CAS Name: 3-[[5-(4,5-dimethyl-1H-pyrazol-3-yl)-2-thiophenyl]sulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[5-(4,5-dimethyl-1H-pyrazol-3-yl)thiophen-2-yl]sulfonylamino]benzoate Traditional Name: 3-[[5-(4,5-dimethyl-1H-pyrazol-3-yl)-2-thienyl]sulfonylamino]benzoic acid ethyl ester Formula: C18H19N3O4S2 MolecularWeight: 405.49116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=CC=C(S2)C3=NNC(=C3C)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=CC=C(S2)C3=NNC(=C3C)C

InChI

InChI=1S/C18H19N3O4S2/c1-4-25-18(22)13-6-5-7-14(10-13)21-27(23,24)16-9-8-15(26-16)17-11(2)12(3)19-20-17/h5-10,21H,4H2,1-3H3,(H,19,20)