| SpectraBase Spectrum ID |
733TIMY5Bgw |
| Name |
2-[(1-benzyl-4-cyano-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]acetic acid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H18N2O2S |
| InChI |
InChI=1S/C19H18N2O2S/c20-11-16-14-8-4-5-9-15(14)17(10-13-6-2-1-3-7-13)21-19(16)24-12-18(22)23/h1-3,6-7H,4-5,8-10,12H2,(H,22,23) |
| InChIKey |
BEDCZJJGFGFCQE-UHFFFAOYSA-N |
| Molecular Weight |
338.425 g/mol |
| SMILES |
OC(=O)CSc1nc(c2c(c1C#N)CCCC2)Cc1ccccc1 |
| SPLASH |
splash10-0006-4390000000-a47133f8bcda62a94cd4 |
| Synonyms |
2-[(1-benzyl-4-cyano-5,6,7,8-tetrahydroisoquinolin-3-yl)thio]acetic acid
2-[[4-cyano-1-(phenylmethyl)-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl]ethanoic acid
2-[[4-cyano-1-(phenylmethyl)-5,6,7,8-tetrahydroisoquinolin-3-yl]thio]acetic acid |
| Wiley ID |
1452088 |
![2-[(1-benzyl-4-cyano-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]acetic acid](/api/spectrum/733TIMY5Bgw/structure.png?h=300&w=458 "2-[(1-benzyl-4-cyano-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]acetic acid")
