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4-Amino-2-pyrimidinethiol
SpectraBase Compound ID C7rmUC07vK1
InChI InChI=1S/C4H5N3S/c5-3-1-2-6-4(8)7-3/h1-2H,(H3,5,6,7,8)
InChIKey DCPSTSVLRXOYGS-UHFFFAOYSA-N
Mol Weight 127.16 g/mol
Molecular Formula C4H5N3S
Exact Mass 127.020418 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3R2XR0nJp2
Name 2(1H)-Pyrimidinethione, 4-amino-
CAS Registry Number 333-49-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H5N3S
InChI InChI=1S/C4H5N3S/c5-3-1-2-6-4(8)7-3/h1-2H,(H3,5,6,7,8)
InChIKey DCPSTSVLRXOYGS-UHFFFAOYSA-N
Molecular Weight 127.165 g/mol
SMILES Nc1nc(ncc1)S
SPLASH splash10-0006-9000000000-831140a63862a5635bce
Source of Spectrum TA-0-628-0
Synonyms 4-Amino-2(1H)-pyrimidinethione 2(1H)-Pyrimidinone, 4-aminothio- 2-Thiocytosine 4-Amino-2-mercaptopyrimidine 4-Aminopyrimidine-2-thiol 6-Amino-1H-pyrimidine-2-thione 6-Azanyl-1H-pyrimidine-2-thione Cytosine, 2-thio- Cytosine, thio- Thiocytosine AI3-52256 EINECS 206-374-3 NSC 211571 NSC 45755
Wiley ID 5021