methyl 5-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[(4-methyl-6-phenyl-2-pyrimidinyl)thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-methyl-6-phenylpyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=CC=C(O3)C(=O)OC

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=CC=C(O3)C(=O)OC

InChI

InChI=1S/C18H16N2O3S/c1-12-10-15(13-6-4-3-5-7-13)20-18(19-12)24-11-14-8-9-16(23-14)17(21)22-2/h3-10H,11H2,1-2H3