Vitas-M small molecule compound
(6Z)-6-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-5-imino-2-(pentan-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL146009
SMILES CCC(c1nn2c(=NC(=O)/C(=C\c3ccc(o3)c3ccc(cc3)F)/C2=N)s1)CC
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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 C21H19FN4O2S MW 410.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19FN4O2S/c1-3-12(4-2)20-25-26-18(23)16(19(27)24-21(26)29-20)11-15-9-10-17(28-15)13-5-7-14(22)8-6-13/h5-12,23H,3-4H2,1-2H3/b16-11-,23-18-InChIKey
BWOZSJRDVGVEHS-CSMICLQESA-NSynonyms
845648-73-9(6Z)6((5(4fluorophenyl)furan2yl)methylidene)5imino2(pentan3yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6((5(4fluorophenyl)furan2yl)methylene)5imino2(pentan3yl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
845648739
CCC(c1nn2c(=NC(=O)C(=Cc3ccc(o3)c3ccc(cc3)F)C2=N)s1)CC
MFCD04167459
ZINC000005178960
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