Vitas-M small molecule compound
(6Z)-2-(2-chlorophenyl)-6-(4-{2-[(4-chlorophenyl)sulfanyl]ethoxy}-3-ethoxybenzylidene)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK064761
SMILES CCOc1cc(ccc1OCCSc1ccc(cc1)Cl)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1ccccc1Cl
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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 C28H22Cl2N4O3S2 MW 597.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22Cl2N4O3S2/c1-2-36-24-16-17(7-12-23(24)37-13-14-38-19-10-8-18(29)9-11-19)15-21-25(31)34-28(32-26(21)35)39-27(33-34)20-5-3-4-6-22(20)30/h3-12,15-16,31H,2,13-14H2,1H3/b21-15-,31-25-InChIKey
PBMPHHQQIFCJDC-PLJOEMTHSA-NSynonyms
(6Z)2(2chlorophenyl)6(4(2((4chlorophenyl)sulfanyl)ethoxy)3ethoxybenzylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCOc1cc(ccc1OCCSc1ccc(cc1)Cl)C=C1C(=O)N=c2n(C1=N)nc(s2)c1ccccc1Cl
MFCD03079076
STK064761
ZINC000008494717
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