Vitas-M small molecule compound
(6E)-6-{[1-(2-fluorobenzyl)-1H-indol-3-yl]methylidene}-5-imino-2-[2-(morpholin-4-yl)-2-oxoethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK555351
SMILES O=C(N1CCOCC1)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 C27H23FN6O3S MW 530.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23FN6O3S/c28-21-7-3-1-5-17(21)15-33-16-18(19-6-2-4-8-22(19)33)13-20-25(29)34-27(30-26(20)36)38-23(31-34)14-24(35)32-9-11-37-12-10-32/h1-8,13,16,29H,9-12,14-15H2/b20-13+,29-25-InChIKey
JUIZTIUGPMHXGM-LQBDTPAUSA-NSynonyms
840516-93-0(6E)6((1(2fluorobenzyl)1Hindol3yl)methylidene)5imino2(2(morpholin4yl)2oxoethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(2fluorobenzyl)1Hindol3yl)methylene)5imino2(2morpholino2oxoethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
840516930
MFCD04010646
O=C(N1CCOCC1)Cc1nn2c(=NC(=O)C(=Cc3cn(c4c3cccc4)Cc3ccccc3F)C2=N)s1
ZINC000101036531
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