2-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]ethanamide Openeye Name: 2-[(6-butyl-3-cyano-2-pyridyl)sulfanyl]-N-[4-(thiazol-2-ylsulfamoyl)phenyl]acetamide CAS Name: 2-[(6-butyl-3-cyano-2-pyridinyl)thio]-N-[4-(2-thiazolylsulfamoyl)phenyl]acetamide IUPAC Name: 2-(6-butyl-3-cyanopyridin-2-yl)sulfanyl-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]acetamide Traditional Name: 2-[(6-butyl-3-cyano-2-pyridyl)thio]-N-[4-(thiazol-2-ylsulfamoyl)phenyl]acetamide Formula: C21H21N5O3S3 MolecularWeight: 487.61814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C=C1)C#N)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

Isomeric SMILES

CCCCC1=NC(=C(C=C1)C#N)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

InChI

InChI=1S/C21H21N5O3S3/c1-2-3-4-16-6-5-15(13-22)20(25-16)31-14-19(27)24-17-7-9-18(10-8-17)32(28,29)26-21-23-11-12-30-21/h5-12H,2-4,14H2,1H3,(H,23,26)(H,24,27)