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Substance Name: Benzothiazole-rifamycin
RN: 78768-62-4
InChIKey: RCBBVQBGDQKRKF-IQZITYDISA-N

Molecular Formula

  • C46-H54-N4-O12-S

Molecular Weight

  • 887.0146
 
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Names and Synonyms

Name of Substance

  • Benzothiazole-rifamycin

Synonym

  • Rifamycin-benzothiazole

Systematic Name

  • Rifamycin, 3-(((3-methyl-2(3H)-benzothiazolylidene)hydrazono)methyl)-

Registry Numbers

CAS Registry Number

  • 78768-62-4

System Generated Number

  • 0078768624

Structure Descriptors

InChI

1S/C46H54N4O12S/c1-21-14-13-15-22(2)44(58)48-35-28(20-47-49-45-50(9)29-16-11-12-17-31(29)63-45)39(55)32-33(40(35)56)38(54)26(6)42-34(32)43(57)46(8,62-42)60-19-18-30(59-10)23(3)41(61-27(7)51)25(5)37(53)24(4)36(21)52/h11-21,23-25,30,36-37,41,52-56H,1-10H3,(H,48,58)/b14-13+,19-18+,22-15-,47-20+,49-45-

InChIKey

RCBBVQBGDQKRKF-IQZITYDISA-N

Smiles

Cc1c(c2c3c4c1OC(C4=O)(O/C=C/C(C(C(C(C(C(C(C(/C=C/C=C(\C(=O)Nc(c2O)c(c3O)/C=N/N=c\5/n(c6ccccc6s5)C)/C)C)O)C)O)C)OC(=O)C)C)OC)C)O