2-(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanyl-2-phenyl-ethanoic acid

Systemtic Name: 2-(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanyl-2-phenyl-ethanoic acid Openeye Name: 2-(4-methyl-6-morpholino-pyrimidin-2-yl)sulfanyl-2-phenyl-acetic acid CAS Name: 2-[[4-methyl-6-(4-morpholinyl)-2-pyrimidinyl]thio]-2-phenylacetic acid IUPAC Name: 2-(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)sulfanyl-2-phenylacetic acid Traditional Name: 2-[(4-methyl-6-morpholino-pyrimidin-2-yl)thio]-2-phenyl-acetic acid Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(C2=CC=CC=C2)C(=O)O)N3CCOCC3

Isomeric SMILES

CC1=CC(=NC(=N1)SC(C2=CC=CC=C2)C(=O)O)N3CCOCC3

InChI

InChI=1S/C17H19N3O3S/c1-12-11-14(20-7-9-23-10-8-20)19-17(18-12)24-15(16(21)22)13-5-3-2-4-6-13/h2-6,11,15H,7-10H2,1H3,(H,21,22)