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Substance Name: Androst-4-en-3-one, 17-alpha-hydroxy-17-beta-(2-(N-methylanilino)-4-thiazolyl)-
RN: 96269-22-6
InChIKey: CEFLRNXAUDDQEM-VHSKNJRQSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H30-N2-O2-S

Molecular Weight

  • 476.6814
 
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Names and Synonyms

Synonym

  • 17-alpha-Hydroxy-17-beta-(2-(N-methylanilino)-4-thiazolyl)androst-4-en-3-one

Systematic Name

  • Androst-4-en-3-one, 17-alpha-hydroxy-17-beta-(2-(N-methylanilino)-4-thiazolyl)-

Registry Numbers

CAS Registry Number

  • 96269-22-6

System Generated Number

  • 0096269226

Structure Descriptors

InChI

1S/C29H36N2O2S/c1-27-14-11-21(32)17-19(27)9-10-22-23(27)12-15-28(2)24(22)13-16-29(28,33)25-18-34-26(30-25)31(3)20-7-5-4-6-8-20/h4-8,17-18,22-24,33H,9-16H2,1-3H3/t22-,23+,24+,27+,28+,29+/m1/s1

InChIKey

CEFLRNXAUDDQEM-VHSKNJRQSA-N

Smiles

C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@]4(c5csc(n5)N(C)c6ccccc6)O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
frog LDLo parenteral 30mg/kg (30mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 11, Pg. 604, 1963.
pigeon LDLo parenteral 5200ug/kg (5.2mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 11, Pg. 604, 1963.