[4-[[4-chloranyl-6-(dimethylamino)pyrimidin-2-yl]sulfanylmethyl]phenyl]-morpholin-4-yl-methanone

Systemtic Name: [4-[[4-chloranyl-6-(dimethylamino)pyrimidin-2-yl]sulfanylmethyl]phenyl]-morpholin-4-yl-methanone Openeye Name: [4-[[4-chloro-6-(dimethylamino)pyrimidin-2-yl]sulfanylmethyl]phenyl]-morpholino-methanone CAS Name: [4-[[[4-chloro-6-(dimethylamino)-2-pyrimidinyl]thio]methyl]phenyl]-(4-morpholinyl)methanone IUPAC Name: [4-[[4-chloro-6-(dimethylamino)pyrimidin-2-yl]sulfanylmethyl]phenyl]-morpholin-4-ylmethanone Traditional Name: [4-[[[4-chloro-6-(dimethylamino)pyrimidin-2-yl]thio]methyl]phenyl]-morpholino-methanone Formula: C18H21ClN4O2S MolecularWeight: 392.90294

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)N3CCOCC3)Cl

Isomeric SMILES

CN(C)C1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)N3CCOCC3)Cl

InChI

InChI=1S/C18H21ClN4O2S/c1-22(2)16-11-15(19)20-18(21-16)26-12-13-3-5-14(6-4-13)17(24)23-7-9-25-10-8-23/h3-6,11H,7-10,12H2,1-2H3