ethyl 5-[[4-(2,3-dimethyl-5-oxidanylidene-4-propan-2-yl-pyrazol-1-yl)phenyl]sulfonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 5-[[4-(2,3-dimethyl-5-oxidanylidene-4-propan-2-yl-pyrazol-1-yl)phenyl]sulfonylamino]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 5-[[4-(4-isopropyl-2,3-dimethyl-5-oxo-pyrazol-1-yl)phenyl]sulfonylamino]benzothiophene-2-carboxylate CAS Name: 5-[[4-(2,3-dimethyl-5-oxo-4-propan-2-yl-1-pyrazolyl)phenyl]sulfonylamino]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[[4-(2,3-dimethyl-5-oxo-4-propan-2-ylpyrazol-1-yl)phenyl]sulfonylamino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[[4-(4-isopropyl-5-keto-2,3-dimethyl-3-pyrazolin-1-yl)phenyl]sulfonylamino]benzothiophene-2-carboxylic acid ethyl ester Formula: C25H27N3O5S2 MolecularWeight: 513.62898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)N4C(=O)C(=C(N4C)C)C(C)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)N4C(=O)C(=C(N4C)C)C(C)C

InChI

InChI=1S/C25H27N3O5S2/c1-6-33-25(30)22-14-17-13-18(7-12-21(17)34-22)26-35(31,32)20-10-8-19(9-11-20)28-24(29)23(15(2)3)16(4)27(28)5/h7-15,26H,6H2,1-5H3