3-[4,6-dimethyl-2-oxidanylidene-1-(1-thiophen-2-ylethyl)pyrimidin-5-yl]propanoic acid

Systemtic Name: 3-[4,6-dimethyl-2-oxidanylidene-1-(1-thiophen-2-ylethyl)pyrimidin-5-yl]propanoic acid Openeye Name: 3-[4,6-dimethyl-2-oxo-1-[1-(2-thienyl)ethyl]pyrimidin-5-yl]propanoic acid CAS Name: 3-[4,6-dimethyl-2-oxo-1-(1-thiophen-2-ylethyl)-5-pyrimidinyl]propanoic acid IUPAC Name: 3-[4,6-dimethyl-2-oxo-1-(1-thiophen-2-ylethyl)pyrimidin-5-yl]propanoic acid Traditional Name: 3-[2-keto-4,6-dimethyl-1-[1-(2-thienyl)ethyl]pyrimidin-5-yl]propionic acid Formula: C15H18N2O3S MolecularWeight: 306.38002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1C(C)C2=CC=CS2)C)CCC(=O)O

Isomeric SMILES

CC1=C(C(=NC(=O)N1C(C)C2=CC=CS2)C)CCC(=O)O

InChI

InChI=1S/C15H18N2O3S/c1-9-12(6-7-14(18)19)10(2)17(15(20)16-9)11(3)13-5-4-8-21-13/h4-5,8,11H,6-7H2,1-3H3,(H,18,19)