5-chloranyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]-2-propan-2-ylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]-2-propan-2-ylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-isopropylsulfanyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[4-[methyl(phenyl)sulfamoyl]phenyl]-2-(propan-2-ylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[4-[methyl(phenyl)sulfamoyl]phenyl]-2-propan-2-ylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(isopropylthio)-N-[4-[methyl(phenyl)sulfamoyl]phenyl]pyrimidine-4-carboxamide Formula: C21H21ClN4O3S2 MolecularWeight: 476.99944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N(C)C3=CC=CC=C3)Cl

Isomeric SMILES

CC(C)SC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N(C)C3=CC=CC=C3)Cl

InChI

InChI=1S/C21H21ClN4O3S2/c1-14(2)30-21-23-13-18(22)19(25-21)20(27)24-15-9-11-17(12-10-15)31(28,29)26(3)16-7-5-4-6-8-16/h4-14H,1-3H3,(H,24,27)