5-chloranyl-2-[(2-fluorophenyl)methylsulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-[(2-fluorophenyl)methylsulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-[(2-fluorophenyl)methylsulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]pyrimidine-4-carboxamide CAS Name: 5-chloro-2-[(2-fluorophenyl)methylthio]-N-[2-(4-sulfamoylphenyl)ethyl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-[(2-fluorophenyl)methylsulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-[(2-fluorobenzyl)thio]-N-[2-(4-sulfamoylphenyl)ethyl]pyrimidine-4-carboxamide Formula: C20H18ClFN4O3S2 MolecularWeight: 480.963323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NC=C(C(=N2)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N)Cl)F

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NC=C(C(=N2)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N)Cl)F

InChI

InChI=1S/C20H18ClFN4O3S2/c21-16-11-25-20(30-12-14-3-1-2-4-17(14)22)26-18(16)19(27)24-10-9-13-5-7-15(8-6-13)31(23,28)29/h1-8,11H,9-10,12H2,(H,24,27)(H2,23,28,29)