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

Systemtic Name: methyl 4-[(1-cyclopentyl-3-thiophen-2-yl-pyrazol-4-yl)sulfonylamino]benzoate Openeye Name: methyl 4-[[1-cyclopentyl-3-(2-thienyl)pyrazol-4-yl]sulfonylamino]benzoate CAS Name: 4-[(1-cyclopentyl-3-thiophen-2-yl-4-pyrazolyl)sulfonylamino]benzoic acid methyl ester IUPAC Name: methyl 4-[(1-cyclopentyl-3-thiophen-2-ylpyrazol-4-yl)sulfonylamino]benzoate Traditional Name: 4-[[1-cyclopentyl-3-(2-thienyl)pyrazol-4-yl]sulfonylamino]benzoic acid methyl ester Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CN(N=C2C3=CC=CS3)C4CCCC4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CN(N=C2C3=CC=CS3)C4CCCC4

InChI

InChI=1S/C20H21N3O4S2/c1-27-20(24)14-8-10-15(11-9-14)22-29(25,26)18-13-23(16-5-2-3-6-16)21-19(18)17-7-4-12-28-17/h4,7-13,16,22H,2-3,5-6H2,1H3