Vitas-M small molecule compound
(6E)-2-(2-cyclohexylethyl)-6-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK712825
SMILES Fc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)CCC1CCCCC1
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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 C26H28FN5OS MW 477.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28FN5OS/c1-16-14-19(17(2)31(16)21-11-9-20(27)10-12-21)15-22-24(28)32-26(29-25(22)33)34-23(30-32)13-8-18-6-4-3-5-7-18/h9-12,14-15,18,28H,3-8,13H2,1-2H3/b22-15+,28-24-InChIKey
GZCQUEVHNZOHDL-ZNBHHVKPSA-NSynonyms
850192-09-5(6E)2(2cyclohexylethyl)6((1(4fluorophenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)2(2cyclohexylethyl)6((1(4fluorophenyl)25dimethyl1Hpyrrol3yl)methylene)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
850192095
Fc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)CCC1CCCCC1
MFCD05690730
ZINC000009309755
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