2-cyclohexylsulfanyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]butanamide

Systemtic Name: 2-cyclohexylsulfanyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]butanamide Openeye Name: 2-cyclohexylsulfanyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]butanamide CAS Name: 2-(cyclohexylthio)-N-[4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl]butanamide IUPAC Name: 2-cyclohexylsulfanyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]butanamide Traditional Name: 2-(cyclohexylthio)-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]butyramide Formula: C21H28N4O3S2 MolecularWeight: 448.60202

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC(=N2)C)SC3CCCCC3

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC(=N2)C)SC3CCCCC3

InChI

InChI=1S/C21H28N4O3S2/c1-3-19(29-17-7-5-4-6-8-17)20(26)24-16-9-11-18(12-10-16)30(27,28)25-21-22-14-13-15(2)23-21/h9-14,17,19H,3-8H2,1-2H3,(H,24,26)(H,22,23,25)