Vitas-M small molecule compound
(6E)-6-{[1-(2-fluorobenzyl)-1H-indol-3-yl]methylidene}-5-imino-2-[2-oxo-2-(piperidin-1-yl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK554937
SMILES O=C(N1CCCCC1)Cc1nn2c(=NC(=O)/C(=C/c3cn(c4c3cccc4)Cc3ccccc3F)/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 C28H25FN6O2S MW 528.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25FN6O2S/c29-22-10-4-2-8-18(22)16-34-17-19(20-9-3-5-11-23(20)34)14-21-26(30)35-28(31-27(21)37)38-24(32-35)15-25(36)33-12-6-1-7-13-33/h2-5,8-11,14,17,30H,1,6-7,12-13,15-16H2/b21-14+,30-26-InChIKey
WAWRHCKEZDFIOO-NXRYEQEMSA-NSynonyms
840486-05-7(6E)6((1(2fluorobenzyl)1Hindol3yl)methylidene)5imino2(2oxo2(piperidin1yl)ethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(2fluorobenzyl)1Hindol3yl)methylene)5imino2(2oxo2(piperidin1yl)ethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
840486057
MFCD04007733
O=C(N1CCCCC1)Cc1nn2c(=NC(=O)C(=Cc3cn(c4c3cccc4)Cc3ccccc3F)C2=N)s1
ZINC000101032620
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