EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H22N4O2 |
| Net Charge | 0 |
| Average Mass | 374.444 |
| Monoisotopic Mass | 374.17428 |
| SMILES | [H]/C(C(=O)N(C([H])([H])[H])C([H])([H])c1c([H])n(C([H])([H])[H])c2c([H])c([H])c([H])c([H])c12)=C(/[H])c1c([H])nc2c(c1[H])C([H])([H])C([H])([H])C(=O)N2[H] |
| InChI | InChI=1S/C22H22N4O2/c1-25-13-17(18-5-3-4-6-19(18)25)14-26(2)21(28)10-7-15-11-16-8-9-20(27)24-22(16)23-12-15/h3-7,10-13H,8-9,14H2,1-2H3,(H,23,24,27)/b10-7+ |
| InChIKey | VAZMNDXVXVUKFY-JXMROGBWSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (E)-N-METHYL-N-(1-METHYL-1H-INDOL-3-YLMETHYL)-3-(7-OXO-5,6,7,8-TETRAHYDRO-[1,8]NAPHTHYRIDIN-3-YL)-ACRYLAMIDE (CHEBI:43311) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| (2E)-N-methyl-N-[(1-methyl-1H-indol-3-yl)methyl]-3-(7-oxo-5,6,7,8-tetrahydro-1,8-naphthyridin-3-yl)prop-2-enamide | PDBeChem |
| (E)-N-METHYL-N-(1-METHYL-1H-INDOL-3-YLMETHYL)-3-(7-OXO-5,6,7,8-TETRAHYDRO-[1,8]NAPHTHYRIDIN-3-YL)-ACRYLAMIDE | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| IDN | PDBeChem |