2-methylsulfanyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyrimidine-4-carboxylate

Systemtic Name: 2-methylsulfanyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyrimidine-4-carboxylate Openeye Name: 2-methylsulfanyl-6-tetralin-6-yl-pyrimidine-4-carboxylate CAS Name: 2-(methylthio)-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-4-pyrimidinecarboxylate IUPAC Name: 2-methylsulfanyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyrimidine-4-carboxylate Traditional Name: 2-(methylthio)-6-tetralin-6-yl-pyrimidine-4-carboxylate Formula: C16H15N2O2S- MolecularWeight: 299.3675

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=CC(=N1)C(=O)[O-])C2=CC3=C(CCCC3)C=C2

Isomeric SMILES

CSC1=NC(=CC(=N1)C(=O)[O-])C2=CC3=C(CCCC3)C=C2

InChI

InChI=1S/C16H16N2O2S/c1-21-16-17-13(9-14(18-16)15(19)20)12-7-6-10-4-2-3-5-11(10)8-12/h6-9H,2-5H2,1H3,(H,19,20)/p-1