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Substance Name: 2-Isothiocyanato-4,5-dichloro-N-methyl-N-(2-(1-pyrrolidinyl)cyclohexyl)benzeneacetamide
RN: 122407-13-0
InChIKey: SPEPFQRDPVNKTR-GGYWPGCISA-N

Molecular Formula

  • C20-H25-Cl2-N3-O-S

Molecular Weight

  • 426.409
 
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Names and Synonyms

Name of Substance

  • 2-Isothiocyanato-4,5-dichloro-N-methyl-N-(2-(1-pyrrolidinyl)cyclohexyl)benzeneacetamide

Synonym

  • UPHIT

Systematic Name

  • Benzeneacetamide, 4,5-dichloro-2-isothiocyanato-N-methyl-N-(2-(1-pyrrolidinyl)cyclohexyl)-, (1S-trans)-

Registry Numbers

CAS Registry Number

  • 122407-13-0

System Generated Number

  • 0122407130

Structure Descriptors

InChI

1S/C20H25Cl2N3OS/c1-24(18-6-2-3-7-19(18)25-8-4-5-9-25)20(26)11-14-10-15(21)16(22)12-17(14)23-13-27/h10,12,18-19H,2-9,11H2,1H3/t18?,19-/m0/s1

InChIKey

SPEPFQRDPVNKTR-GGYWPGCISA-N

Smiles

c1(c(cc(c(c1)Cl)Cl)N=C=S)CC(=O)[N@@]([C@H]1[C@H](CCCC1)N1CCCC1)C