Vitas-M small molecule compound
(6Z)-5-imino-6-{3-methoxy-4-[2-(3-methylphenoxy)ethoxy]benzylidene}-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL238826
SMILES COc1cc(ccc1OCCOc1cccc(c1)C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
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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 C27H23N5O4S MW 513.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N5O4S/c1-17-5-3-7-20(13-17)35-11-12-36-22-9-8-18(15-23(22)34-2)14-21-24(28)32-27(30-25(21)33)37-26(31-32)19-6-4-10-29-16-19/h3-10,13-16,28H,11-12H2,1-2H3/b21-14-,28-24-InChIKey
RGEPLJWWJDCHNF-JTCIKWTMSA-NSynonyms
846065-00-7(6Z)5imino6(3methoxy4(2(3methylphenoxy)ethoxy)benzylidene)2(pyridin3yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)5imino6(3methoxy4(2(mtolyloxy)ethoxy)benzylidene)2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
846065007
COc1cc(ccc1OCCOc1cccc(c1)C)C=C1C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
MFCD04173983
ZINC000009304126
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