2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]butanamide

Systemtic Name: 2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]butanamide Openeye Name: 2-(3-chloro-N-methylsulfonyl-anilino)-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]butanamide CAS Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl]butanamide IUPAC Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]butanamide Traditional Name: 2-(3-chloro-N-mesyl-anilino)-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]butyramide Formula: C22H24ClN5O5S2 MolecularWeight: 538.03946

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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)N(C3=CC(=CC=C3)Cl)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC(=N2)C)N(C3=CC(=CC=C3)Cl)S(=O)(=O)C

InChI

InChI=1S/C22H24ClN5O5S2/c1-4-20(28(34(3,30)31)18-7-5-6-16(23)14-18)21(29)26-17-8-10-19(11-9-17)35(32,33)27-22-24-13-12-15(2)25-22/h5-14,20H,4H2,1-3H3,(H,26,29)(H,24,25,27)