EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C25H23N3OS |
| Net Charge | 0 |
| Average Mass | 413.546 |
| Monoisotopic Mass | 413.15618 |
| SMILES | N#C[C@H]1[C@H](c2ccc(C3=CCCC3)cc2)[C@H](CO)N1c1nc(-c2ccccc2)cs1 |
| InChI | InChI=1S/C25H23N3OS/c26-14-22-24(20-12-10-18(11-13-20)17-6-4-5-7-17)23(15-29)28(22)25-27-21(16-30-25)19-8-2-1-3-9-19/h1-3,6,8-13,16,22-24,29H,4-5,7,15H2/t22-,23-,24-/m0/s1 |
| InChIKey | YWUOOJZCEOJKLU-HJOGWXRNSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (2R,3S,4R)-3-[4-(cyclopenten-1-yl)phenyl]-4-(hydroxymethyl)-1-(4-phenyl-1,3-thiazol-2-yl)azetidine-2-carbonitrile (CHEBI:98177) is a azetidines (CHEBI:38777) |
| (2R,3S,4R)-3-[4-(cyclopenten-1-yl)phenyl]-4-(hydroxymethyl)-1-(4-phenyl-1,3-thiazol-2-yl)azetidine-2-carbonitrile (CHEBI:98177) is a benzenes (CHEBI:22712) |
| (2R,3S,4R)-3-[4-(cyclopenten-1-yl)phenyl]-4-(hydroxymethyl)-1-(4-phenyl-1,3-thiazol-2-yl)azetidine-2-carbonitrile (CHEBI:98177) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-9556 | LINCS |