6W0
Summary
| Name: | ~{N}-[3-(methoxymethyl)phenyl]-4-methyl-thieno[3,2-b]pyrrole-5-carboxamide |
| Formula: | C16 H16 N2 O2 S |
| Formal charge: | 0 |
| Formula weight: | 300.375 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | ~{N}-[3-(methoxymethyl)phenyl]-4-methyl-thieno[3,2-b]pyrrole-5-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H16N2O2S/c1-18-13-6-7-21-15(13)9-14(18)16(19)17-12-5-3-4-11(8-12)10-20-2/h3-9H,10H2,1-2H3,(H,17,19) |
| InChIKey | InChI | 1.03 | ZQZRVLFBPXQREF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COCc1cccc(NC(=O)c2cc3sccc3n2C)c1 |
| SMILES | CACTVS | 3.385 | COCc1cccc(NC(=O)c2cc3sccc3n2C)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | Cn1c2ccsc2cc1C(=O)Nc3cccc(c3)COC |
| SMILES | OpenEye OEToolkits | 2.0.5 | Cn1c2ccsc2cc1C(=O)Nc3cccc(c3)COC |
