Vitas-M small molecule compound
(6Z)-6-{3-chloro-4-[(3-methylbenzyl)oxy]benzylidene}-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
STL238740
SMILES Cc1cccc(c1)COc1ccc(cc1Cl)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCCCC1
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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 C27H26ClN5O3S MW 536.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN5O3S/c1-17-6-5-7-19(12-17)16-36-22-9-8-18(14-21(22)28)13-20-25(29)33-27(30-26(20)35)37-23(31-33)15-24(34)32-10-3-2-4-11-32/h5-9,12-14,29H,2-4,10-11,15-16H2,1H3/b20-13-,29-25-InChIKey
DOYBHBLELFZFIV-VDYSANCASA-NSynonyms
843671-01-2(6Z)6(3chloro4((3methylbenzyl)oxy)benzylidene)5imino2(2oxo2(piperidin1yl)ethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(3chloro4((3methylbenzyl)oxy)benzylidene)5imino2(2oxo2(piperidin1yl)ethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
843671012
Cc1cccc(c1)COc1ccc(cc1Cl)C=C1C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCCCC1
MFCD04163156
ZINC000101104908
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