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Substance Name: N-((5-((3-(2,4-Diamino-1,6-dihydro-6-oxo-5-pyrimidinyl)propyl)amino)-2-thienoyl)carbonyl)glutamic acid
RN: 158010-68-5
InChIKey: XZEOVCAIZUBENT-VIFPVBQESA-N

Molecular Formula

  • C17-H22-N6-O6-S

Molecular Weight

  • 438.463
 
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Names and Synonyms

Name of Substance

  • N-((5-((3-(2,4-Diamino-1,6-dihydro-6-oxo-5-pyrimidinyl)propyl)amino)-2-thienoyl)carbonyl)glutamic acid

Synonyms

  • Doptcga
  • N-((5-((3-(2,6-Diamino-1,4-dihydro-4-oxo-5-pyrimidinyl)propyl)amino)-2-thienyl)carbonyl)-L-glutamic acid

Systematic Name

  • L-Glutamic acid, N-((5-((3-(2,6-diamino-1,4-dihydro-4-oxo-5-pyrimidinyl)propyl)amino)-2-thienyl)carbonyl)-

Registry Numbers

CAS Registry Number

  • 158010-68-5

System Generated Number

  • 0158010685

Structure Descriptors

InChI

1S/C17H22N6O6S/c18-13-8(14(26)23-17(19)22-13)2-1-7-20-11-5-4-10(30-11)15(27)21-9(16(28)29)3-6-12(24)25/h4-5,9,20H,1-3,6-7H2,(H,21,27)(H,24,25)(H,28,29)(H5,18,19,22,23,26)/t9-/m0/s1

InChIKey

XZEOVCAIZUBENT-VIFPVBQESA-N

Smiles

s1c(ccc1NCCCc1c([nH]c(nc1=O)N)N)C(N[C@@H](CCC(O)=O)C(=O)O)=O