4-(2,3-dihydro-1-benzofuran-5-yl)-2-methylsulfanyl-pyrimidine

Systemtic Name: 4-(2,3-dihydro-1-benzofuran-5-yl)-2-methylsulfanyl-pyrimidine Openeye Name: 4-(2,3-dihydrobenzofuran-5-yl)-2-methylsulfanyl-pyrimidine CAS Name: 4-(2,3-dihydrobenzofuran-5-yl)-2-(methylthio)pyrimidine IUPAC Name: 4-(2,3-dihydro-1-benzofuran-5-yl)-2-methylsulfanylpyrimidine Traditional Name: 4-coumaran-5-yl-2-(methylthio)pyrimidine Formula: C13H12N2OS MolecularWeight: 244.31218

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=N1)C2=CC3=C(C=C2)OCC3

Isomeric SMILES

CSC1=NC=CC(=N1)C2=CC3=C(C=C2)OCC3

InChI

InChI=1S/C13H12N2OS/c1-17-13-14-6-4-11(15-13)9-2-3-12-10(8-9)5-7-16-12/h2-4,6,8H,5,7H2,1H3