Vitas-M small molecule compound
(6Z)-6-{3-chloro-4-[2-(3,5-dimethylphenoxy)ethoxy]benzylidene}-5-imino-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK555489
SMILES Cc1cc(OCCOc2ccc(cc2Cl)/C=C/2\C(=O)N=c3n(C2=N)nc(s3)c2cccnc2)cc(c1)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 C27H22ClN5O3S MW 532.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClN5O3S/c1-16-10-17(2)12-20(11-16)35-8-9-36-23-6-5-18(14-22(23)28)13-21-24(29)33-27(31-25(21)34)37-26(32-33)19-4-3-7-30-15-19/h3-7,10-15,29H,8-9H2,1-2H3/b21-13-,29-24-InChIKey
HPODGHMDSIXPQH-AIFZOKMXSA-NSynonyms
841208-49-9(6Z)6(3chloro4(2(35dimethylphenoxy)ethoxy)benzylidene)5imino2(pyridin3yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(3chloro4(2(35dimethylphenoxy)ethoxy)benzylidene)5imino2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
841208499
Cc1cc(OCCOc2ccc(cc2Cl)C=C2C(=O)N=c3n(C2=N)nc(s3)c2cccnc2)cc(c1)C
MFCD04011591
ZINC000100945869
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