5-[(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: 5-[(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: 5-[(4-methyl-6-morpholino-pyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[4-methyl-6-(4-morpholinyl)-2-pyrimidinyl]thio]methyl]-2-furancarboxylate IUPAC Name: 5-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(4-methyl-6-morpholino-pyrimidin-2-yl)thio]methyl]-2-furoate Formula: C15H16N3O4S- MolecularWeight: 334.37024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)[O-])N3CCOCC3

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)[O-])N3CCOCC3

InChI

InChI=1S/C15H17N3O4S/c1-10-8-13(18-4-6-21-7-5-18)17-15(16-10)23-9-11-2-3-12(22-11)14(19)20/h2-3,8H,4-7,9H2,1H3,(H,19,20)/p-1