3-[(1,3-Benzodioxol-5-ylcarbonyl)amino]-1,2,3,4-tetrahydro-5-methyl-4-oxo-2-thioxothieno[2,3-d]pyrimidine-6-carboxylic acid

CAS Registry Number®

667437-24-3

CAS Name

3-[(1,3-Benzodioxol-5-ylcarbonyl)amino]-1,2,3,4-tetrahydro-5-methyl-4-oxo-2-thioxothieno[2,3-d]pyrimidine-6-carboxylic acid

Molecular Formula

C16H11N3O6S2

Molecular Mass

405.40

Cite this Page

3-[(1,3-Benzodioxol-5-ylcarbonyl)amino]-1,2,3,4-tetrahydro-5-methyl-4-oxo-2-thioxothieno[2,3-d]pyrimidine-6-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=667437-24-3 (retrieved 2024-10-12) (CAS RN: 667437-24-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H11N3O6S2/c1-6-10-13(27-11(6)15(22)23)17-16(26)19(14(10)21)18-12(20)7-2-3-8-9(4-7)25-5-24-8/h2-4H,5H2,1H3,(H,17,26)(H,18,20)(H,22,23)

InChIKey

InChIKey=LXXRTOOKUIBZRR-UHFFFAOYSA-N

SMILES

O=C1C2=C(SC(C(O)=O)=C2C)NC(=S)N1NC(=O)C=3C=C4C(=CC3)OCO4

Canonical SMILES

O=C(O)C=1SC=2NC(=S)N(NC(=O)C3=CC=C4OCOC4=C3)C(=O)C2C1C

Other Names for this Substance

  • Thieno[2,3-d]pyrimidine-6-carboxylic acid, 3-[(1,3-benzodioxol-5-ylcarbonyl)amino]-1,2,3,4-tetrahydro-5-methyl-4-oxo-2-thioxo-
  • 3-[(1,3-Benzodioxol-5-ylcarbonyl)amino]-1,2,3,4-tetrahydro-5-methyl-4-oxo-2-thioxothieno[2,3-d]pyrimidine-6-carboxylic acid

CAS INSIGHTSTM
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