| PDB CCD ID: | J93 |
| Number of entries in FURNA: | 2 |
| Chemical formula: | C19 H15 N3 O S2 |
| InChI: | InChI=1S/C19H15N3OS2/c1-22(6-7-23)19-10-18-17(25-19)9-16(24-18)8-15(12-21)14-4-2-13(11-20)3-5-14/h2-5,8-10,23H,6-7H2,1H3/b15-8+ |
| InChIKey: | RIGJCKIIBUZTCX-OVCLIPMQSA-N |
| SMILES: | CN(CCO)c1sc2cc(sc2c1)\C=C(/C#N)c3ccc(cc3)C#N; CN(CCO)c1cc2c(s1)cc(s2)/C=C(\C#N)/c3ccc(cc3)C#N; CN(CCO)c1cc2c(s1)cc(s2)C=C(C#N)c3ccc(cc3)C#N; CN(CCO)c1sc2cc(sc2c1)C=C(C#N)c3ccc(cc3)C#N |
| Name: | 4-[(~{Z})-1-cyano-2-[5-[2-hydroxyethyl(methyl)amino]thieno[3,2-b]thiophen-2-yl]ethenyl]benzenecarbonitrile |
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