SpectraBase Spectrum ID |
2qAXMzskyj5 |
Name |
2-[[2-[(4,6-diamino-2-pyrimidinyl)thio]-1-oxoethyl]amino]-3-(phenylmethylthio)propanoic acid methyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H21N5O3S2 |
InChI |
InChI=1S/C17H21N5O3S2/c1-25-16(24)12(9-26-8-11-5-3-2-4-6-11)20-15(23)10-27-17-21-13(18)7-14(19)22-17/h2-7,12H,8-10H2,1H3,(H,20,23)(H4,18,19,21,22) |
InChIKey |
RPNDVTXUFKIAQC-UHFFFAOYSA-N |
Molecular Weight |
407.507 g/mol |
SMILES |
N(C(CSc1nc(cc(n1)N)N)=O)C(CSCc1ccccc1)C(OC)=O |
SPLASH |
splash10-05nf-9801000000-79b43b260ccd978aa016 |
Synonyms |
3-(benzylthio)-2-[[2-[(4,6-diaminopyrimidin-2-yl)thio]acetyl]amino]propionic acid methyl ester
Methyl 2-[2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylethanoylamino]-3-(phenylmethylsulfanyl)propanoate
Methyl 3-benzylsulfanyl-2-[[2-(4,6-diaminopyrimidin-2-yl)sulfanylacetyl]amino]propanoate |
Wiley ID |
1512257 |