SpectraBase Spectrum ID |
AGG3OyS18bV |
Name |
Propanoic acid, 2-[[2-(1,3-benzoxazol-2-ylthio)acetyl]amino]-3-[(phenylmethyl)thio]-, methyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H20N2O4S2 |
InChI |
InChI=1S/C20H20N2O4S2/c1-25-19(24)16(12-27-11-14-7-3-2-4-8-14)21-18(23)13-28-20-22-15-9-5-6-10-17(15)26-20/h2-10,16H,11-13H2,1H3,(H,21,23) |
InChIKey |
RXBFNJOIGJBWKP-UHFFFAOYSA-N |
Molecular Weight |
416.510 g/mol |
SMILES |
N(C(CSc1nc2c(o1)cccc2)=O)C(CSCc1ccccc1)C(OC)=O |
SPLASH |
splash10-0006-9801000000-4dc7c8b6ef37f285602e |
Source of Spectrum |
IY-1-4489-2 |
Synonyms |
2-[[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]amino]-3-(phenylmethylthio)propanoic acid methyl ester
Methyl 2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-3-benzylsulfanylpropanoate
Methyl 2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-3-benzylsulfanyl-propanoate
Methyl 2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylamino]-3-(phenylmethylsulfanyl)propanoate |
Wiley ID |
1652875 |