Vitas-M small molecule compound
(6Z)-5-imino-6-{3-methoxy-4-[(3-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
STL241256
SMILES COc1cc(ccc1OCc1cccc(c1)C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCOCC1
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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 C27H27N5O5S MW 533.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O5S/c1-17-4-3-5-19(12-17)16-37-21-7-6-18(14-22(21)35-2)13-20-25(28)32-27(29-26(20)34)38-23(30-32)15-24(33)31-8-10-36-11-9-31/h3-7,12-14,28H,8-11,15-16H2,1-2H3/b20-13-,28-25-InChIKey
SSXJJMSDBJLSQV-YUYSWHJYSA-NSynonyms
848748-61-8(6Z)5imino6(3methoxy4((3methylbenzyl)oxy)benzylidene)2(2(morpholin4yl)2oxoethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)5imino6(3methoxy4((3methylbenzyl)oxy)benzylidene)2(2morpholino2oxoethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
848748618
COc1cc(ccc1OCc1cccc(c1)C)C=C1C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCOCC1
MFCD04196172
ZINC000101171852
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