N-[[(2R)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[[(2R)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-[[(2R)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-[[(2R)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-[[(2R)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-[[(2R)-5-ethoxy-2-methyl-coumaran-6-yl]methyl]-2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]acetamide Formula: C21H27N3O4S MolecularWeight: 417.52178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)NCC2=C(C=C3CC(OC3=C2)C)OCC

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)NCC2=C(C=C3C[C@H](OC3=C2)C)OCC

InChI

InChI=1S/C21H27N3O4S/c1-4-6-16-10-19(25)24-21(23-16)29-12-20(26)22-11-15-9-18-14(7-13(3)28-18)8-17(15)27-5-2/h8-10,13H,4-7,11-12H2,1-3H3,(H,22,26)(H,23,24,25)/t13-/m1/s1