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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-(5-(trifluoromethyl)-2-pyridinyl)-
RN: 183856-69-1
InChIKey: HPZHVLWFMURXBI-VNXDFUDDSA-N

Molecular Formula

  • C47-H40-F6-N6-O5

Molecular Weight

  • 882.858
 
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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-(5-trifluoromethyl-2-pyridinyl)benzamide)

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-(5-(trifluoromethyl)-2-pyridinyl)-

Registry Numbers

CAS Registry Number

  • 183856-69-1

System Generated Number

  • 0183856691

Structure Descriptors

InChI

1S/C47H40F6N6O5/c48-46(49,50)35-17-19-39(54-25-35)56-43(62)33-15-7-13-31(21-33)27-58-37(23-29-9-3-1-4-10-29)41(60)42(61)38(24-30-11-5-2-6-12-30)59(45(58)64)28-32-14-8-16-34(22-32)44(63)57-40-20-18-36(26-55-40)47(51,52)53/h1-22,25-26,37-38,41-42,60-61H,23-24,27-28H2,(H,54,56,62)(H,55,57,63)/t37-,38-,41+,42+/m1/s1

InChIKey

HPZHVLWFMURXBI-VNXDFUDDSA-N

Smiles

c1ccc(cc1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2Cc3cccc(c3)C(=O)Nc4ccc(cn4)C(F)(F)F)Cc5cccc(c5)C(=O)Nc6ccc(cn6)C(F)(F)F)Cc7ccccc7)O)O