Vitas-M small molecule compound
3-({(E)-[4-(trifluoromethyl)phenyl]methylidene}amino)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL380252
SMILES O=c1n(/N=C/c2ccc(cc2)C(F)(F)F)cnc2c1c1CCCCc1s2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C18H14F3N3OS MW 377.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14F3N3OS/c19-18(20,21)12-7-5-11(6-8-12)9-23-24-10-22-16-15(17(24)25)13-3-1-2-4-14(13)26-16/h5-10H,1-4H2/b23-9+InChIKey
QAOAYABQHDFION-NUGSKGIGSA-NSynonyms
3(((E)(4(trifluoromethyl)phenyl)methylidene)amino)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3((E)(4(trifluoromethyl)phenyl)methylideneamino)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
C1CCC2=C(C1)C3=C(S2)N=CN(C3=O)N=CC4=CC=C(C=C4)C(F)(F)F
InChI=1SC18H14F3N3OSc1918(2021)127511(6812)9232410221615(17(24)25)13312414(13)2616h510H14H2b239+
MFCD03923733
O=c1n(N=Cc2ccc(cc2)C(F)(F)F)cnc2c1c1CCCCc1s2
ZINC000002123588
ZINC02123586
ZINC2123586
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