Vitas-M small molecule compound
(6Z)-6-{4-[(3,4-dichlorobenzyl)oxy]-3-ethoxybenzylidene}-5-imino-2-(4-methylphenyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK097129
SMILES CCOc1cc(ccc1OCc1ccc(c(c1)Cl)Cl)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1ccc(cc1)C
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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 C28H22Cl2N4O3S MW 565.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22Cl2N4O3S/c1-3-36-24-14-17(7-11-23(24)37-15-18-6-10-21(29)22(30)13-18)12-20-25(31)34-28(32-26(20)35)38-27(33-34)19-8-4-16(2)5-9-19/h4-14,31H,3,15H2,1-2H3/b20-12-,31-25-InChIKey
QVBDIHHRVHFTCZ-TXCMYEJISA-NSynonyms
(6Z)6(4((34dichlorobenzyl)oxy)3ethoxybenzylidene)5imino2(4methylphenyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCOc1cc(ccc1OCc1ccc(c(c1)Cl)Cl)C=C1C(=O)N=c2n(C1=N)nc(s2)c1ccc(cc1)C
MFCD09960118
STK097129
ZINC000097966234
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