4-bromanyl-N-[4-(4-cyanopyridin-2-yl)-3-(pyridin-2-ylmethylsulfanyl)-1H-pyrazol-5-yl]thiophene-2-sulfonamide

Systemtic Name: 4-bromanyl-N-[4-(4-cyanopyridin-2-yl)-3-(pyridin-2-ylmethylsulfanyl)-1H-pyrazol-5-yl]thiophene-2-sulfonamide Openeye Name: 4-bromo-N-[4-(4-cyano-2-pyridyl)-3-(2-pyridylmethylsulfanyl)-1H-pyrazol-5-yl]thiophene-2-sulfonamide CAS Name: 4-bromo-N-[4-(4-cyano-2-pyridinyl)-3-(2-pyridinylmethylthio)-1H-pyrazol-5-yl]-2-thiophenesulfonamide IUPAC Name: 4-bromo-N-[4-(4-cyanopyridin-2-yl)-3-(pyridin-2-ylmethylsulfanyl)-1H-pyrazol-5-yl]thiophene-2-sulfonamide Traditional Name: 4-bromo-N-[4-(4-cyano-2-pyridyl)-3-(2-pyridylmethylthio)-1H-pyrazol-5-yl]thiophene-2-sulfonamide Formula: C19H13BrN6O2S3 MolecularWeight: 533.44452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CSC2=NNC(=C2C3=NC=CC(=C3)C#N)NS(=O)(=O)C4=CC(=CS4)Br

Isomeric SMILES

C1=CC=NC(=C1)CSC2=NNC(=C2C3=NC=CC(=C3)C#N)NS(=O)(=O)C4=CC(=CS4)Br

InChI

InChI=1S/C19H13BrN6O2S3/c20-13-8-16(29-10-13)31(27,28)26-18-17(15-7-12(9-21)4-6-23-15)19(25-24-18)30-11-14-3-1-2-5-22-14/h1-8,10H,11H2,(H2,24,25,26)