4-chloranyl-3,5-bis(3,4-dimethoxyphenyl)-1-thiophen-2-ylsulfonyl-pyrazole

Systemtic Name: 4-chloranyl-3,5-bis(3,4-dimethoxyphenyl)-1-thiophen-2-ylsulfonyl-pyrazole Openeye Name: 4-chloro-3,5-bis(3,4-dimethoxyphenyl)-1-(2-thienylsulfonyl)pyrazole CAS Name: 4-chloro-3,5-bis(3,4-dimethoxyphenyl)-1-thiophen-2-ylsulfonylpyrazole IUPAC Name: 4-chloro-3,5-bis(3,4-dimethoxyphenyl)-1-thiophen-2-ylsulfonylpyrazole Traditional Name: 4-chloro-3,5-bis(3,4-dimethoxyphenyl)-1-(2-thienylsulfonyl)pyrazole Formula: C23H21ClN2O6S2 MolecularWeight: 521.00564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=NN2S(=O)(=O)C3=CC=CS3)C4=CC(=C(C=C4)OC)OC)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=NN2S(=O)(=O)C3=CC=CS3)C4=CC(=C(C=C4)OC)OC)Cl)OC

InChI

InChI=1S/C23H21ClN2O6S2/c1-29-16-9-7-14(12-18(16)31-3)22-21(24)23(15-8-10-17(30-2)19(13-15)32-4)26(25-22)34(27,28)20-6-5-11-33-20/h5-13H,1-4H3