5-chloranyl-2-methylsulfanyl-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-methylsulfanyl-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-methylsulfanyl-N-[(6-morpholino-3-pyridyl)methyl]pyrimidine-4-carboxamide CAS Name: 5-chloro-2-(methylthio)-N-[[6-(4-morpholinyl)-3-pyridinyl]methyl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-methylsulfanyl-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(methylthio)-N-[(6-morpholino-3-pyridyl)methyl]pyrimidine-4-carboxamide Formula: C16H18ClN5O2S MolecularWeight: 379.86442

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)NCC2=CN=C(C=C2)N3CCOCC3)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)NCC2=CN=C(C=C2)N3CCOCC3)Cl

InChI

InChI=1S/C16H18ClN5O2S/c1-25-16-20-10-12(17)14(21-16)15(23)19-9-11-2-3-13(18-8-11)22-4-6-24-7-5-22/h2-3,8,10H,4-7,9H2,1H3,(H,19,23)