| SpectraBase Spectrum ID |
4vpObKdK5r6 |
| Name |
(4-cyanophenyl)methyl carbamimidothioate |
| Alternate Name(s) |
2-(4-Cyanobenzyl)isothiourea
2-[(4-Cyanophenyl)methyl]isothiourea
Carbamimidothioic acid (4-cyanophenyl)methyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H9N3S |
| InChI |
InChI=1S/C9H9N3S/c10-5-7-1-3-8(4-2-7)6-13-9(11)12/h1-4H,6H2,(H3,11,12) |
| InChIKey |
GUWGDCBFBSPGKP-UHFFFAOYSA-N |
| Molecular Weight |
191.252 g/mol |
| SMILES |
N=C(SCc1ccc(C#N)cc1)N |
| SPLASH |
splash10-0006-4900000000-52b0a6ae73ce167af6a9 |
| Source of Spectrum |
H-81-655-3 |
| Wiley ID |
1187375 |
