3-[[5-methyl-2,4-bis(oxidanylidene)-1H-pyrimidin-3-yl]methyl]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[[5-methyl-2,4-bis(oxidanylidene)-1H-pyrimidin-3-yl]methyl]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[(5-methyl-2,4-dioxo-1H-pyrimidin-3-yl)methyl]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[(5-methyl-2,4-dioxo-1H-pyrimidin-3-yl)methyl]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[(5-methyl-2,4-dioxo-1H-pyrimidin-3-yl)methyl]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[(2,4-diketo-5-methyl-1H-pyrimidin-3-yl)methyl]-5-phenyl-2-thenoic acid Formula: C17H14N2O4S MolecularWeight: 342.36906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC(=O)N(C1=O)CC2=C(SC(=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=CNC(=O)N(C1=O)CC2=C(SC(=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C17H14N2O4S/c1-10-8-18-17(23)19(15(10)20)9-12-7-13(24-14(12)16(21)22)11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,18,23)(H,21,22)