2-[(2-methylphenyl)methylsulfanyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-[(2-methylphenyl)methylsulfanyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]ethanamide Openeye Name: 2-(o-tolylmethylsulfanyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide CAS Name: 2-[(2-methylphenyl)methylthio]-N-[4-(2-pyrimidinylsulfamoyl)phenyl]acetamide IUPAC Name: 2-[(2-methylphenyl)methylsulfanyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide Traditional Name: 2-[(2-methylbenzyl)thio]-N-[4-(2-pyrimidylsulfamoyl)phenyl]acetamide Formula: C20H20N4O3S2 MolecularWeight: 428.5278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3

Isomeric SMILES

CC1=CC=CC=C1CSCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3

InChI

InChI=1S/C20H20N4O3S2/c1-15-5-2-3-6-16(15)13-28-14-19(25)23-17-7-9-18(10-8-17)29(26,27)24-20-21-11-4-12-22-20/h2-12H,13-14H2,1H3,(H,23,25)(H,21,22,24)