Vitas-M small molecule compound
(6E)-6-{[1-(2-ethoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-(2-fluorophenyl)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224859
SMILES CCOc1ccccc1n1c(C)cc(c1C)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)c1ccccc1F
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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 C26H22FN5O2S MW 487.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22FN5O2S/c1-4-34-22-12-8-7-11-21(22)31-15(2)13-17(16(31)3)14-19-23(28)32-26(29-24(19)33)35-25(30-32)18-9-5-6-10-20(18)27/h5-14,28H,4H2,1-3H3/b19-14+,28-23-InChIKey
RVXILCOLKHBENZ-YALHWJLNSA-NSynonyms
877807-99-3(6E)6((1(2ethoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)2(2fluorophenyl)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(2ethoxyphenyl)25dimethyl1Hpyrrol3yl)methylene)2(2fluorophenyl)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
877807993
CCOc1ccccc1n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)c1ccccc1F
MFCD05705796
ZINC000009293664
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