2-methylsulfanyl-5-naphthalen-1-yl-pyrimidine-4-carboxylic acid

Systemtic Name: 2-methylsulfanyl-5-naphthalen-1-yl-pyrimidine-4-carboxylic acid Openeye Name: 2-methylsulfanyl-5-(1-naphthyl)pyrimidine-4-carboxylic acid CAS Name: 2-(methylthio)-5-(1-naphthalenyl)-4-pyrimidinecarboxylic acid IUPAC Name: 2-methylsulfanyl-5-naphthalen-1-ylpyrimidine-4-carboxylic acid Traditional Name: 2-(methylthio)-5-(1-naphthyl)pyrimidine-4-carboxylic acid Formula: C16H12N2O2S MolecularWeight: 296.34368

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C16H12N2O2S/c1-21-16-17-9-13(14(18-16)15(19)20)12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H,19,20)