1-[2-(2-chlorophenyl)ethyl]-5,6-bis(oxidanylidene)-2-thiophen-2-yl-4H-pyrimidine-4-carboxylic acid

Systemtic Name: 1-[2-(2-chlorophenyl)ethyl]-5,6-bis(oxidanylidene)-2-thiophen-2-yl-4H-pyrimidine-4-carboxylic acid Openeye Name: 1-[2-(2-chlorophenyl)ethyl]-5,6-dioxo-2-(2-thienyl)-4H-pyrimidine-4-carboxylic acid CAS Name: 1-[2-(2-chlorophenyl)ethyl]-5,6-dioxo-2-thiophen-2-yl-4H-pyrimidine-4-carboxylic acid IUPAC Name: 1-[2-(2-chlorophenyl)ethyl]-5,6-dioxo-2-thiophen-2-yl-4H-pyrimidine-4-carboxylic acid Traditional Name: 1-[2-(2-chlorophenyl)ethyl]-5,6-diketo-2-(2-thienyl)-4H-pyrimidine-4-carboxylic acid Formula: C17H13ClN2O4S MolecularWeight: 376.81412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCN2C(=NC(C(=O)C2=O)C(=O)O)C3=CC=CS3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CCN2C(=NC(C(=O)C2=O)C(=O)O)C3=CC=CS3)Cl

InChI

InChI=1S/C17H13ClN2O4S/c18-11-5-2-1-4-10(11)7-8-20-15(12-6-3-9-25-12)19-13(17(23)24)14(21)16(20)22/h1-6,9,13H,7-8H2,(H,23,24)