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Substance Name: Benzamide, 3,3'-(((4R,5S,6S,7R)-tetrahydro-5,6-dihydroxy-2-oxo-4,7-bis(phenylmethyl)-1H-1,3-diazepine-1,3(2H)-diyl)bis(methylene))bis(N-4-pyridinyl-
RN: 183854-15-1
InChIKey: QERMHAOACKVOPG-GLGKVNTQSA-N

Molecular Formula

  • C45-H42-N6-O5

Molecular Weight

  • 746.8638
 
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Names and Synonyms

Synonym

  • (4aalpha,5alpha,6beta,7beta)-3,3'-(Tetrahydro-5,6-dihydroxy-2-oxo-4,7-bis(phenylmethy)-1H-1,3-diazepine-1,3(2H)-diyl)bis(methylene)bis(N-4-pyridinylbenzamide)

Systematic Name

  • Benzamide, 3,3'-(((4R,5S,6S,7R)-tetrahydro-5,6-dihydroxy-2-oxo-4,7-bis(phenylmethyl)-1H-1,3-diazepine-1,3(2H)-diyl)bis(methylene))bis(N-4-pyridinyl-

Registry Numbers

CAS Registry Number

  • 183854-15-1

System Generated Number

  • 0183854151

Structure Descriptors

InChI

1S/C45H42N6O5/c52-41-39(27-31-9-3-1-4-10-31)50(29-33-13-7-15-35(25-33)43(54)48-37-17-21-46-22-18-37)45(56)51(40(42(41)53)28-32-11-5-2-6-12-32)30-34-14-8-16-36(26-34)44(55)49-38-19-23-47-24-20-38/h1-26,39-42,52-53H,27-30H2,(H,46,48,54)(H,47,49,55)/t39-,40-,41+,42+/m1/s1

InChIKey

QERMHAOACKVOPG-GLGKVNTQSA-N

Smiles

c1ccc(cc1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2Cc3cccc(c3)C(=O)Nc4ccncc4)Cc5cccc(c5)C(=O)Nc6ccncc6)Cc7ccccc7)O)O