Vitas-M small molecule compound
(6Z)-5-imino-6-{4-[(2-methylbenzyl)oxy]benzylidene}-2-[2-(morpholin-4-yl)-2-oxoethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL240742
SMILES O=C(N1CCOCC1)Cc1nn2c(=NC(=O)/C(=C\c3ccc(cc3)OCc3ccccc3C)/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 C26H25N5O4S MW 503.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O4S/c1-17-4-2-3-5-19(17)16-35-20-8-6-18(7-9-20)14-21-24(27)31-26(28-25(21)33)36-22(29-31)15-23(32)30-10-12-34-13-11-30/h2-9,14,27H,10-13,15-16H2,1H3/b21-14-,27-24-InChIKey
KKQNMLRRKSGKGA-QFVKKHJYSA-NSynonyms
844832-98-0(6Z)5imino6(4((2methylbenzyl)oxy)benzylidene)2(2(morpholin4yl)2oxoethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)5imino6(4((2methylbenzyl)oxy)benzylidene)2(2morpholino2oxoethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
844832980
MFCD04163566
O=C(N1CCOCC1)Cc1nn2c(=NC(=O)C(=Cc3ccc(cc3)OCc3ccccc3C)C2=N)s1
ZINC000009280918
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