| SpectraBase Spectrum ID |
ALTlRogdbFL |
| Name |
2-[[4-allyl-5-(3-nitrophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H12N4O4S |
| InChI |
InChI=1S/C13H12N4O4S/c1-2-6-16-12(14-15-13(16)22-8-11(18)19)9-4-3-5-10(7-9)17(20)21/h2-5,7H,1,6,8H2,(H,18,19) |
| InChIKey |
KVJWYSYJYQHASM-UHFFFAOYSA-N |
| Molecular Weight |
320.323 g/mol |
| SMILES |
OC(CSc1[n](c(nn1)-c1cc(N(=O)=O)ccc1)CC=C)=O |
| SPLASH |
splash10-004i-6690000000-8e0f4980cf41bbf489c7 |
| Synonyms |
2-[[4-allyl-5-(3-nitrophenyl)-1,2,4-triazol-3-yl]thio]acetic acid
2-[[5-(3-nitrophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid
2-[[5-(3-nitrophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid
2-[[5-(3-nitrophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]acetic acid |
| Wiley ID |
1451887 |
![acetic acid, [[5-(3-nitrophenyl)-4-(2-propenyl)-4H-1,2,4-triazol-3-yl]thio]-](/api/spectrum/ALTlRogdbFL/structure.png?h=300&w=458 "acetic acid, [[5-(3-nitrophenyl)-4-(2-propenyl)-4H-1,2,4-triazol-3-yl]thio]-")
