2-[[4-(dimethylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]propanoic acid

Systemtic Name: 2-[[4-(dimethylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]propanoic acid Openeye Name: 2-[[4-(dimethylamino)-6-morpholino-1,3,5-triazin-2-yl]sulfanyl]propanoic acid CAS Name: 2-[[4-(dimethylamino)-6-(4-morpholinyl)-1,3,5-triazin-2-yl]thio]propanoic acid IUPAC Name: 2-[[4-(dimethylamino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]sulfanyl]propanoic acid Traditional Name: 2-[[4-(dimethylamino)-6-morpholino-s-triazin-2-yl]thio]propionic acid Formula: C12H19N5O3S MolecularWeight: 313.37596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NC(=NC(=N1)N(C)C)N2CCOCC2

Isomeric SMILES

CC(C(=O)O)SC1=NC(=NC(=N1)N(C)C)N2CCOCC2

InChI

InChI=1S/C12H19N5O3S/c1-8(9(18)19)21-12-14-10(16(2)3)13-11(15-12)17-4-6-20-7-5-17/h8H,4-7H2,1-3H3,(H,18,19)