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Substance Name: 3-Pyrrolidinecarboxamide, 4,5-dioxo-N-methyl-1-(1-methylethyl)-N-(4-(phenylthio)phenyl)-
RN: 77711-85-4
InChIKey: VVPPQVNHQGUJOH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H22-N2-O3-S

Molecular Weight

  • 382.4818
 
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Names and Synonyms

Synonyms

  • 4,5-Dioxo-N-methyl-1-(1-methylethyl)-N-(4-(phenylthio)phenyl)-3-pyrrolidinecarboxamide
  • BRN 5147637

Systematic Name

  • 3-Pyrrolidinecarboxamide, 4,5-dioxo-N-methyl-1-(1-methylethyl)-N-(4-(phenylthio)phenyl)-

Registry Numbers

CAS Registry Number

  • 77711-85-4

System Generated Number

  • 0077711854

Structure Descriptors

InChI

1S/C21H22N2O3S/c1-14(2)23-13-18(19(24)21(23)26)20(25)22(3)15-9-11-17(12-10-15)27-16-7-5-4-6-8-16/h4-12,14,18H,13H2,1-3H3

InChIKey

VVPPQVNHQGUJOH-UHFFFAOYSA-N

Smiles

CC(C)N1CC(C(=O)C1=O)C(=O)N(C)c2ccc(cc2)Sc3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 24, Pg. 889, 1981.