| SpectraBase Spectrum ID |
FSNpHNq8D8e |
| Name |
2(1H)-Isoquinolinecarbothioic acid, 1-cyano-1-methyl-, S-ethyl ester |
| Alternate Name(s) |
S-Ethyl 1-cyano-1-methyl-2(1H)-isoquinolinecarbothioate
1-cyano-1-methyl-2-isoquinolinecarbothioic acid S-ethyl ester
1-cyano-1-methyl-isoquinoline-2-carbothioic acid S-ethyl ester
S-ethyl 1-cyano-1-methyl-isoquinoline-2-carbothioate |
| CAS Registry Number |
17954-39-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H14N2OS |
| InChI |
InChI=1S/C14H14N2OS/c1-3-18-13(17)16-9-8-11-6-4-5-7-12(11)14(16,2)10-15/h4-9H,3H2,1-2H3 |
| InChIKey |
BVVTYDOKQUQKEP-UHFFFAOYSA-N |
| Molecular Weight |
258.339 g/mol |
| SMILES |
CCSC(N1C=Cc2ccccc2C1(C)C#N)=O |
| SPLASH |
splash10-054o-4930000000-3a6d6eeb54854b4fc622 |
| Source of Spectrum |
O-3-1077-11 |
| Wiley ID |
36743 |
