Vitas-M small molecule compound
(6E)-6-{[1-(2-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-(4-fluorophenyl)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224785
SMILES Fc1ccc(cc1)c1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3ccccc3Cl)C)/C2=N)s1
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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 C24H17ClFN5OS MW 477.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17ClFN5OS/c1-13-11-16(14(2)30(13)20-6-4-3-5-19(20)25)12-18-21(27)31-24(28-22(18)32)33-23(29-31)15-7-9-17(26)10-8-15/h3-12,27H,1-2H3/b18-12+,27-21-InChIKey
BOAMVWPUHVQXKO-DTQJXXPGSA-NSynonyms
849920-71-4(6E)6((1(2chlorophenyl)25dimethyl1Hpyrrol3yl)methylidene)2(4fluorophenyl)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(2chlorophenyl)25dimethyl1Hpyrrol3yl)methylene)2(4fluorophenyl)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
849920714
Fc1ccc(cc1)c1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3ccccc3Cl)C)C2=N)s1
MFCD05689310
ZINC000009309651
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