EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C17H16N4O2S2 |
| Net Charge | 0 |
| Average Mass | 372.475 |
| Monoisotopic Mass | 372.07147 |
| SMILES | Cn1c2cc(S(C)=O)sc2c2cnn(Cc3cccc(N)c3)c(=O)c21 |
| InChI | InChI=1S/C17H16N4O2S2/c1-20-13-7-14(25(2)23)24-16(13)12-8-19-21(17(22)15(12)20)9-10-4-3-5-11(18)6-10/h3-8H,9,18H2,1-2H3 |
| InChIKey | ZWKJWVSEDISQIS-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| TEPP-46 (CHEBI:746968) is a organic heterotricyclic compound (CHEBI:26979) |
| TEPP-46 (CHEBI:746968) is a substituted aniline (CHEBI:48975) |
| TEPP-46 (CHEBI:746968) is a sulfone (CHEBI:35850) |
| IUPAC Name |
|---|
| 6-(3-aminobenzyl)-4-methyl-2-(methylsulfinyl)-4,6-dihydro-5H-thieno[2',3':4,5]pyrrolo[2,3-d]pyridazin-5-one |
| Synonym | Source |
|---|---|
| ML265 | IUPHAR |
| Registry Numbers | Sources |
|---|---|
| CAS:1221186-53-3 | CAS |