Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 4-(3-Isothiocyanate-4-methoxyphenyl)-6,6''-bis(N,N-di-(carboxymethylaminomethyl))-2,2'-6',2''-terpyridine
RN: 157837-77-9
InChIKey: LLAAIHCOOOWFFP-UHFFFAOYSA-N

Molecular Formula

  • C33-H30-N6-O9-S

Molecular Weight

  • 686.699
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • 4-(3-Isothiocyanate-4-methoxyphenyl)-6,6''-bis(N,N-di-(carboxymethylaminomethyl))-2,2'-6',2''-terpyridine

Synonym

  • Tmt-NSC

Systematic Name

  • Glycine, N,N'-((4'-(3-isothiocyanato-4-methoxyphenyl)(2,2':6',2''-terpyridine)-6,6''-diyl)bis(methylene))bis(N-(carboxymethyl)-

Registry Numbers

CAS Registry Number

  • 157837-77-9

Related Registry Number

  • 142958-33-6 (tetra-hydrochloride salt)

System Generated Number

  • 0157837779

Structure Descriptors

InChI

1S/C33H30N6O9S/c1-48-29-9-8-20(10-28(29)34-19-49)21-11-26(24-6-2-4-22(35-24)13-38(15-30(40)41)16-31(42)43)37-27(12-21)25-7-3-5-23(36-25)14-39(17-32(44)45)18-33(46)47/h2-12H,13-18H2,1H3,(H,40,41)(H,42,43)(H,44,45)(H,46,47)

InChIKey

LLAAIHCOOOWFFP-UHFFFAOYSA-N

Smiles

c1(cccc(n1)CN(CC(=O)O)CC(=O)O)c1cc(cc(n1)c1cccc(n1)CN(CC(=O)O)CC(=O)O)c1cc(c(cc1)OC)N=C=S