31E
Summary
| Name: | (Z)-[(furan-2-ylmethyl)imino]methanethiol |
| Formula: | C6 H7 N O S |
| Formal charge: | 0 |
| Formula weight: | 141.191 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (Z)-[(furan-2-ylmethyl)imino]methanethiol |
| OpenEye OEToolkits | 1.9.2 | (1Z)-N-(furan-2-ylmethyl)methanimidothioic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | S\C=N/Cc1occc1 |
| InChI | InChI | 1.03 | InChI=1S/C6H7NOS/c9-5-7-4-6-2-1-3-8-6/h1-3,5H,4H2,(H,7,9) |
| InChIKey | InChI | 1.03 | BDAKRWHGDWIWEU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | SC=NCc1occc1 |
| SMILES | CACTVS | 3.385 | SC=NCc1occc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1cc(oc1)C/N=C\S |
| SMILES | OpenEye OEToolkits | 1.9.2 | c1cc(oc1)CN=CS |
