N-(5-chloranyl-2-oxidanyl-phenyl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-sulfonamide

Systemtic Name: N-(5-chloranyl-2-oxidanyl-phenyl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-sulfonamide Openeye Name: 1-benzyl-N-(5-chloro-2-hydroxy-phenyl)-3-(2-thienyl)pyrazole-4-sulfonamide CAS Name: N-(5-chloro-2-hydroxyphenyl)-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-N-(5-chloro-2-hydroxyphenyl)-3-thiophen-2-ylpyrazole-4-sulfonamide Traditional Name: 1-benzyl-N-(5-chloro-2-hydroxy-phenyl)-3-(2-thienyl)pyrazole-4-sulfonamide Formula: C20H16ClN3O3S2 MolecularWeight: 445.94234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)S(=O)(=O)NC4=C(C=CC(=C4)Cl)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)S(=O)(=O)NC4=C(C=CC(=C4)Cl)O

InChI

InChI=1S/C20H16ClN3O3S2/c21-15-8-9-17(25)16(11-15)23-29(26,27)19-13-24(12-14-5-2-1-3-6-14)22-20(19)18-7-4-10-28-18/h1-11,13,23,25H,12H2