5-chloranyl-2-methylsulfanyl-N-(4-morpholin-4-ylsulfonylphenyl)pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-methylsulfanyl-N-(4-morpholin-4-ylsulfonylphenyl)pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-methylsulfanyl-N-(4-morpholinosulfonylphenyl)pyrimidine-4-carboxamide CAS Name: 5-chloro-2-(methylthio)-N-[4-(4-morpholinylsulfonyl)phenyl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-methylsulfanyl-N-(4-morpholin-4-ylsulfonylphenyl)pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(methylthio)-N-(4-morpholinosulfonylphenyl)pyrimidine-4-carboxamide Formula: C16H17ClN4O4S2 MolecularWeight: 428.91358

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)Cl

InChI

InChI=1S/C16H17ClN4O4S2/c1-26-16-18-10-13(17)14(20-16)15(22)19-11-2-4-12(5-3-11)27(23,24)21-6-8-25-9-7-21/h2-5,10H,6-9H2,1H3,(H,19,22)