1-methyl-2-[3-(2-naphthalen-1-ylethylsulfonylamino)thiophen-2-yl]-5,6-bis(oxidanylidene)-4H-pyrimidine-4-carboxylic acid

Systemtic Name: 1-methyl-2-[3-(2-naphthalen-1-ylethylsulfonylamino)thiophen-2-yl]-5,6-bis(oxidanylidene)-4H-pyrimidine-4-carboxylic acid Openeye Name: 1-methyl-2-[3-[2-(1-naphthyl)ethylsulfonylamino]-2-thienyl]-5,6-dioxo-4H-pyrimidine-4-carboxylic acid CAS Name: 1-methyl-2-[3-[2-(1-naphthalenyl)ethylsulfonylamino]-2-thiophenyl]-5,6-dioxo-4H-pyrimidine-4-carboxylic acid IUPAC Name: 1-methyl-2-[3-(2-naphthalen-1-ylethylsulfonylamino)thiophen-2-yl]-5,6-dioxo-4H-pyrimidine-4-carboxylic acid Traditional Name: 5,6-diketo-1-methyl-2-[3-[2-(1-naphthyl)ethylsulfonylamino]-2-thienyl]-4H-pyrimidine-4-carboxylic acid Formula: C22H19N3O6S2 MolecularWeight: 485.53276

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(C(=O)C1=O)C(=O)O)C2=C(C=CS2)NS(=O)(=O)CCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CN1C(=NC(C(=O)C1=O)C(=O)O)C2=C(C=CS2)NS(=O)(=O)CCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H19N3O6S2/c1-25-20(23-17(22(28)29)18(26)21(25)27)19-16(9-11-32-19)24-33(30,31)12-10-14-7-4-6-13-5-2-3-8-15(13)14/h2-9,11,17,24H,10,12H2,1H3,(H,28,29)