Vitas-M small molecule compound
(6Z)-6-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-ethoxybenzylidene)-5-imino-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK070072
SMILES CCOc1cc(ccc1OCCOc1ccc(cc1)C(CC)C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CCC
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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 C29H34N4O4S MW 534.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N4O4S/c1-5-8-26-32-33-27(30)23(28(34)31-29(33)38-26)17-20-9-14-24(25(18-20)35-7-3)37-16-15-36-22-12-10-21(11-13-22)19(4)6-2/h9-14,17-19,30H,5-8,15-16H2,1-4H3/b23-17-,30-27-InChIKey
NHAGZUWEQCPCAK-QAIAOQBTSA-NSynonyms
(6Z)6(4(2(4(butan2yl)phenoxy)ethoxy)3ethoxybenzylidene)5imino2propyl56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCOc1cc(ccc1OCCOc1ccc(cc1)C(CC)C)C=C1C(=O)N=c2n(C1=N)nc(s2)CCC
MFCD02118695
STK070072
ZINC000100656670
ZINC000100656675
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