5-chloranyl-N-(3-chloranyl-4-morpholin-4-yl-phenyl)-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-(3-chloranyl-4-morpholin-4-yl-phenyl)-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-(3-chloro-4-morpholino-phenyl)-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[3-chloro-4-(4-morpholinyl)phenyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-(3-chloro-4-morpholin-4-ylphenyl)-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-(3-chloro-4-morpholino-phenyl)-2-(methylthio)pyrimidine-4-carboxamide Formula: C16H16Cl2N4O2S MolecularWeight: 399.29484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16Cl2N4O2S/c1-25-16-19-9-12(18)14(21-16)15(23)20-10-2-3-13(11(17)8-10)22-4-6-24-7-5-22/h2-3,8-9H,4-7H2,1H3,(H,20,23)