(2S)-N-[[(2R)-7-chloranyl-5-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-1-ethanoyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[[(2R)-7-chloranyl-5-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-1-ethanoyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-1-acetyl-N-[[(2R)-7-chloro-5-pyrazin-2-yl-2,3-dihydrobenzofuran-2-yl]methyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-acetyl-N-[[(2R)-7-chloro-5-(2-pyrazinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-acetyl-N-[[(2R)-7-chloro-5-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-acetyl-N-[[(2R)-7-chloro-5-pyrazin-2-yl-coumaran-2-yl]methyl]pyrrolidine-2-carboxamide Formula: C20H21ClN4O3 MolecularWeight: 400.85874

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC1C(=O)NCC2CC3=C(O2)C(=CC(=C3)C4=NC=CN=C4)Cl

Isomeric SMILES

CC(=O)N1CCC[C@H]1C(=O)NC[C@H]2CC3=C(O2)C(=CC(=C3)C4=NC=CN=C4)Cl

InChI

InChI=1S/C20H21ClN4O3/c1-12(26)25-6-2-3-18(25)20(27)24-10-15-8-14-7-13(9-16(21)19(14)28-15)17-11-22-4-5-23-17/h4-5,7,9,11,15,18H,2-3,6,8,10H2,1H3,(H,24,27)/t15-,18+/m1/s1