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Substance Name: NSC 12131
RN: 3438-72-0
UNII: G3UL61S8MR
InChIKey: UOKDZZRHBUPEQL-UHFFFAOYSA-N

Molecular Formula

  • C12-H10-N4-O2-S

Molecular Weight

  • 274.303
 
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Names and Synonyms

Results Name

  • NSC 12131

Name of Substance

  • 1-Benzyl-2-mercapto-1H-imidazo(4,5-d)pyridazine-4,7-diol

Synonyms

  • NSC 12131
  • UNII-G3UL61S8MR

Systematic Name

  • 1H-Imidazo(4,5-d)pyridazine-4,7-dione, 2,3,5,6-tetrahydro-1-(phenylmethyl)-2-thioxo-

Registry Numbers

CAS Registry Number

  • 3438-72-0

FDA UNII

  • G3UL61S8MR

System Generated Number

  • 0003438720

Structure Descriptors

InChI

1S/C12H10N4O2S/c17-10-8-9(11(18)15-14-10)16(12(19)13-8)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,13,19)(H,14,17)(H,15,18)

InChIKey

UOKDZZRHBUPEQL-UHFFFAOYSA-N

Smiles

c1ccc(cc1)Cn2c3c(c(=O)[nH][nH]c3=O)[nH]c2=S