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

Systemtic Name: 2-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]butanamide Openeye Name: 2-[(6-butyl-3-cyano-2-pyridyl)sulfanyl]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]butanamide CAS Name: 2-[(6-butyl-3-cyano-2-pyridinyl)thio]-N-[4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl]butanamide IUPAC Name: 2-(6-butyl-3-cyanopyridin-2-yl)sulfanyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]butanamide Traditional Name: 2-[(6-butyl-3-cyano-2-pyridyl)thio]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]butyramide Formula: C25H28N6O3S2 MolecularWeight: 524.65822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28N6O3S2/c1-4-6-7-19-9-8-18(16-26)24(30-19)35-22(5-2)23(32)29-20-10-12-21(13-11-20)36(33,34)31-25-27-15-14-17(3)28-25/h8-15,22H,4-7H2,1-3H3,(H,29,32)(H,27,28,31)