5-chloranyl-2-methylsulfonyl-N-(4-morpholin-4-ylphenyl)pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-methylsulfonyl-N-(4-morpholin-4-ylphenyl)pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-methylsulfonyl-N-(4-morpholinophenyl)pyrimidine-4-carboxamide CAS Name: 5-chloro-2-methylsulfonyl-N-[4-(4-morpholinyl)phenyl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-methylsulfonyl-N-(4-morpholin-4-ylphenyl)pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-mesyl-N-(4-morpholinophenyl)pyrimidine-4-carboxamide Formula: C16H17ClN4O4S MolecularWeight: 396.84858

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)N3CCOCC3)Cl

Isomeric SMILES

CS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)N3CCOCC3)Cl

InChI

InChI=1S/C16H17ClN4O4S/c1-26(23,24)16-18-10-13(17)14(20-16)15(22)19-11-2-4-12(5-3-11)21-6-8-25-9-7-21/h2-5,10H,6-9H2,1H3,(H,19,22)