2-(3-cyano-6-propyl-pyridin-2-yl)sulfanyl-N-[4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]propanamide

Systemtic Name: 2-(3-cyano-6-propyl-pyridin-2-yl)sulfanyl-N-[4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]propanamide Openeye Name: 2-[(3-cyano-6-propyl-2-pyridyl)sulfanyl]-N-[4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]propanamide CAS Name: 2-[(3-cyano-6-propyl-2-pyridinyl)thio]-N-[4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]propanamide IUPAC Name: 2-(3-cyano-6-propylpyridin-2-yl)sulfanyl-N-[4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]propanamide Traditional Name: 2-[(3-cyano-6-propyl-2-pyridyl)thio]-N-[4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]propionamide Formula: C21H22N6O3S3 MolecularWeight: 502.63278

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(C=C1)C#N)SC(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NN=C(S3)C

Isomeric SMILES

CCCC1=NC(=C(C=C1)C#N)SC(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NN=C(S3)C

InChI

InChI=1S/C21H22N6O3S3/c1-4-5-16-7-6-15(12-22)20(24-16)31-13(2)19(28)23-17-8-10-18(11-9-17)33(29,30)27-21-26-25-14(3)32-21/h6-11,13H,4-5H2,1-3H3,(H,23,28)(H,26,27)