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Substance Name: 2-Propenamide, 2-cyano-N-(6-methoxy-2-benzothiazolyl)-3-phenyl-
RN: 160893-90-3
InChIKey: GNWOEFVKNCEIJB-UKTHLTGXSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H13-N3-O2-S

Molecular Weight

  • 335.3857
 
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Names and Synonyms

Synonym

  • 2-Cyano-N-(6-methoxy-2-benzothiazolyl)-3-phenyl-2-propenamide

Systematic Name

  • 2-Propenamide, 2-cyano-N-(6-methoxy-2-benzothiazolyl)-3-phenyl-

Registry Numbers

CAS Registry Number

  • 160893-90-3

System Generated Number

  • 0160893903

Structure Descriptors

InChI

1S/C18H13N3O2S/c1-23-14-7-8-15-16(10-14)24-18(20-15)21-17(22)13(11-19)9-12-5-3-2-4-6-12/h2-10H,1H3,(H,20,21,22)/b13-9+

InChIKey

GNWOEFVKNCEIJB-UKTHLTGXSA-N

Smiles

COc1ccc2c(c1)sc(n2)NC(=O)/C(=C/c3ccccc3)/C#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500mg/kg (500mg/kg)   Pharmazie. Vol. 49, Pg. 880, 1994.
mouse LD50 oral 1gm/kg (1000mg/kg)   Pharmazie. Vol. 49, Pg. 880, 1994.