4-[ethyl-(4-methylsulfanylphenyl)sulfonyl-amino]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]benzamide

Systemtic Name: 4-[ethyl-(4-methylsulfanylphenyl)sulfonyl-amino]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]benzamide Openeye Name: 4-[ethyl-(4-methylsulfanylphenyl)sulfonyl-amino]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]benzamide CAS Name: 4-[ethyl-[4-(methylthio)phenyl]sulfonylamino]-N-[4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl]benzamide IUPAC Name: 4-[ethyl-(4-methylsulfanylphenyl)sulfonylamino]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]benzamide Traditional Name: 4-[ethyl-[4-(methylthio)phenyl]sulfonyl-amino]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]benzamide Formula: C27H27N5O5S3 MolecularWeight: 597.72878

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC(=N3)C)S(=O)(=O)C4=CC=C(C=C4)SC

Isomeric SMILES

CCN(C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC(=N3)C)S(=O)(=O)C4=CC=C(C=C4)SC

InChI

InChI=1S/C27H27N5O5S3/c1-4-32(40(36,37)25-15-11-23(38-3)12-16-25)22-9-5-20(6-10-22)26(33)30-21-7-13-24(14-8-21)39(34,35)31-27-28-18-17-19(2)29-27/h5-18H,4H2,1-3H3,(H,30,33)(H,28,29,31)