Vitas-M small molecule compound
(6Z)-6-{4-[2-(4-chloro-3-methylphenoxy)ethoxy]-3-ethoxy-5-iodobenzylidene}-2-cyclohexyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK095324
SMILES CCOc1cc(cc(c1OCCOc1ccc(c(c1)C)Cl)I)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C1CCCCC1
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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 C29H30ClIN4O4S MW 693.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30ClIN4O4S/c1-3-37-24-16-18(15-23(31)25(24)39-12-11-38-20-9-10-22(30)17(2)13-20)14-21-26(32)35-29(33-27(21)36)40-28(34-35)19-7-5-4-6-8-19/h9-10,13-16,19,32H,3-8,11-12H2,1-2H3/b21-14-,32-26-InChIKey
UVHUZSSPPDQGSO-FLSOJJQWSA-NSynonyms
(6Z)6(4(2(4chloro3methylphenoxy)ethoxy)3ethoxy5iodobenzylidene)2cyclohexyl5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCOc1cc(cc(c1OCCOc1ccc(c(c1)C)Cl)I)C=C1C(=O)N=c2n(C1=N)nc(s2)C1CCCCC1
MFCD08672673
STK095324
ZINC000097959402
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