N-[(1S)-1-[[[(4R,7S)-HEXAHYDRO-7-METHYL-3-OXO-1-(2-PYRIDINYLSULFONYL)-1H-AZEPIN-4-YL]AMINO]CARBONYL]-3-METHYLBUTYL]-2-BENZOFURANCARBOXAMIDE

CAS No.
362507-64-0
CCD No.
CCD02009916
Formula
C27 H32 N4 O6 S
MolWeight
540.638

Basic Information

Product Name: N-[(1S)-1-[[[(4R,7S)-HEXAHYDRO-7-METHYL-3-OXO-1-(2-PYRIDINYLSULFONYL)-1H-AZEPIN-4-YL]AMINO]CARBONYL]-3-METHYLBUTYL]-2-BENZOFURANCARBOXAMIDE
CAS: 362507-64-0
English Synonyms: N-[(1S)-1-[[[(4R,7S)-HEXAHYDRO-7-METHYL-3-OXO-1-(2-PYRIDINYLSULFONYL)-1H-AZEPIN-4-YL]AMINO]CARBONYL]-3-METHYLBUTYL]-2-BENZOFURANCARBOXAMIDE
MDL Number.: MFCD13194785
H bond acceptor: 10
H bond donor: 2
Smile: C[C@H]1CC[C@H](C(=O)CN1S(=O)(=O)c2ccccn2)NC(=O)[C@H](CC(C)C)NC(=O)c3cc4ccccc4o3
InChi: InChI=1S/C27H32N4O6S/c1-17(2)14-21(30-27(34)24-15-19-8-4-5-9-23(19)37-24)26(33)29-20-12-11-18(3)31(16-22(20)32)38(35,36)25-10-6-7-13-28-25/h4-10,13,15,17-18,20-21H,11-12,14,16H2,1-3H3,(H,29,33)(H,30,34)/t18-,20+,21-/m0/s1
InChiKey: InChIKey=BWYBBMQLUKXECQ-TYPHKJRUSA-N

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