5-chloranyl-2-[(3-methylphenyl)methylsulfonyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-[(3-methylphenyl)methylsulfonyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-(m-tolylmethylsulfonyl)-N-[4-(thiazol-2-ylsulfamoyl)phenyl]pyrimidine-4-carboxamide CAS Name: 5-chloro-2-[(3-methylphenyl)methylsulfonyl]-N-[4-(2-thiazolylsulfamoyl)phenyl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-[(3-methylphenyl)methylsulfonyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(3-methylbenzyl)sulfonyl-N-[4-(thiazol-2-ylsulfamoyl)phenyl]pyrimidine-4-carboxamide Formula: C22H18ClN5O5S3 MolecularWeight: 564.05682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CS(=O)(=O)C2=NC=C(C(=N2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CS4)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)C2=NC=C(C(=N2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CS4)Cl

InChI

InChI=1S/C22H18ClN5O5S3/c1-14-3-2-4-15(11-14)13-35(30,31)22-25-12-18(23)19(27-22)20(29)26-16-5-7-17(8-6-16)36(32,33)28-21-24-9-10-34-21/h2-12H,13H2,1H3,(H,24,28)(H,26,29)