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Substance Name: Ethanone, 1-(4,5-dihydro-4-phenyl-5-(phenylmethyl)-5-(1-piperidinyl)-1,3,4-thiadiazol-2-yl)-
RN: 139617-46-2
InChIKey: ZGVLCQSILMLAAX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H25-N3-O-S

Molecular Weight

  • 379.5255
 
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Names and Synonyms

Synonym

  • 1-(4,5-Dihydro-4-phenyl-5-(phenylmethyl)-5-(1-piperidinyl)-1,3,4-thiadiazol-2-yl)ethanone

Systematic Name

  • Ethanone, 1-(4,5-dihydro-4-phenyl-5-(phenylmethyl)-5-(1-piperidinyl)-1,3,4-thiadiazol-2-yl)-

Registry Numbers

CAS Registry Number

  • 139617-46-2

System Generated Number

  • 0139617462

Structure Descriptors

InChI

1S/C22H25N3OS/c1-18(26)21-23-25(20-13-7-3-8-14-20)22(27-21,24-15-9-4-10-16-24)17-19-11-5-2-6-12-19/h2-3,5-8,11-14H,4,9-10,15-17H2,1H3

InChIKey

ZGVLCQSILMLAAX-UHFFFAOYSA-N

Smiles

CC(=O)C1=NN(C(S1)(Cc2ccccc2)N3CCCCC3)c4ccccc4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 1gm/kg (1000mg/kg)   Pharmaceutical Chemistry Journal Vol. 28, Pg. 99, 1994.