3-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]propanamide

Systemtic Name: 3-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]propanamide Openeye Name: 3-[(6-butyl-3-cyano-2-pyridyl)sulfanyl]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]propanamide CAS Name: 3-[(6-butyl-3-cyano-2-pyridinyl)thio]-N-[4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl]propanamide IUPAC Name: 3-(6-butyl-3-cyanopyridin-2-yl)sulfanyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]propanamide Traditional Name: 3-[(6-butyl-3-cyano-2-pyridyl)thio]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]propionamide Formula: C24H26N6O3S2 MolecularWeight: 510.63164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C=C1)C#N)SCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC(=N3)C

Isomeric SMILES

CCCCC1=NC(=C(C=C1)C#N)SCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC(=N3)C

InChI

InChI=1S/C24H26N6O3S2/c1-3-4-5-19-7-6-18(16-25)23(29-19)34-15-13-22(31)28-20-8-10-21(11-9-20)35(32,33)30-24-26-14-12-17(2)27-24/h6-12,14H,3-5,13,15H2,1-2H3,(H,28,31)(H,26,27,30)