N-[[(2R)-5-chloranyl-7-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[[(2R)-5-chloranyl-7-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanamide Openeye Name: N-[[(2R)-5-chloro-7-pyrazin-2-yl-2,3-dihydrobenzofuran-2-yl]methyl]-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetamide CAS Name: N-[[(2R)-5-chloro-7-(2-pyrazinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetamide IUPAC Name: N-[[(2R)-5-chloro-7-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetamide Traditional Name: N-[[(2R)-5-chloro-7-pyrazin-2-yl-coumaran-2-yl]methyl]-2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetamide Formula: C23H20ClN5O2S MolecularWeight: 465.9552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)NCC3CC4=C(O3)C(=CC(=C4)Cl)C5=NC=CN=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC[C@H]3CC4=C(O3)C(=CC(=C4)Cl)C5=NC=CN=C5

InChI

InChI=1S/C23H20ClN5O2S/c1-13-2-3-18-19(6-13)29-23(28-18)32-12-21(30)27-10-16-8-14-7-15(24)9-17(22(14)31-16)20-11-25-4-5-26-20/h2-7,9,11,16H,8,10,12H2,1H3,(H,27,30)(H,28,29)/t16-/m1/s1