butyl 4-[(1-methyl-3-thiophen-2-yl-pyrazol-4-yl)sulfonylamino]benzoate

Systemtic Name: butyl 4-[(1-methyl-3-thiophen-2-yl-pyrazol-4-yl)sulfonylamino]benzoate Openeye Name: butyl 4-[[1-methyl-3-(2-thienyl)pyrazol-4-yl]sulfonylamino]benzoate CAS Name: 4-[(1-methyl-3-thiophen-2-yl-4-pyrazolyl)sulfonylamino]benzoic acid butyl ester IUPAC Name: butyl 4-[(1-methyl-3-thiophen-2-ylpyrazol-4-yl)sulfonylamino]benzoate Traditional Name: 4-[[1-methyl-3-(2-thienyl)pyrazol-4-yl]sulfonylamino]benzoic acid butyl ester Formula: C19H21N3O4S2 MolecularWeight: 419.51774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CN(N=C2C3=CC=CS3)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CN(N=C2C3=CC=CS3)C

InChI

InChI=1S/C19H21N3O4S2/c1-3-4-11-26-19(23)14-7-9-15(10-8-14)21-28(24,25)17-13-22(2)20-18(17)16-6-5-12-27-16/h5-10,12-13,21H,3-4,11H2,1-2H3