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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-(4,6-dimethyl-2-pyridinyl)-
RN: 183855-10-9
InChIKey: LFGJUVNTHXGQFQ-KTKZDIBBSA-N

Molecular Formula

  • C49-H50-N6-O5

Molecular Weight

  • 802.971
 
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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-(4,6-dimethyl-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-(4,6-dimethyl-2-pyridinyl)-

Registry Numbers

CAS Registry Number

  • 183855-10-9

System Generated Number

  • 0183855109

Structure Descriptors

InChI

1S/C49H50N6O5/c1-31-21-33(3)50-43(23-31)52-47(58)39-19-11-17-37(25-39)29-54-41(27-35-13-7-5-8-14-35)45(56)46(57)42(28-36-15-9-6-10-16-36)55(49(54)60)30-38-18-12-20-40(26-38)48(59)53-44-24-32(2)22-34(4)51-44/h5-26,41-42,45-46,56-57H,27-30H2,1-4H3,(H,50,52,58)(H,51,53,59)/t41-,42-,45+,46+/m1/s1

InChIKey

LFGJUVNTHXGQFQ-KTKZDIBBSA-N

Smiles

Cc1cc(nc(c1)NC(=O)c2cccc(c2)CN3[C@@H]([C@@H]([C@H]([C@H](N(C3=O)Cc4cccc(c4)C(=O)Nc5cc(cc(n5)C)C)Cc6ccccc6)O)O)Cc7ccccc7)C