Vitas-M small molecule compound
3-[(Z)-{3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]-2-[4-(4-methoxyphenyl)piperazin-1-yl]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK799567
SMILES COc1ccc(cc1)N1CCN(CC1)c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCc1ccc(c(c1)OC)OC
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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 C33H33N5O5S2 MW 643.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33N5O5S2/c1-41-24-10-8-23(9-11-24)35-16-18-36(19-17-35)30-25(31(39)37-14-5-4-6-29(37)34-30)21-28-32(40)38(33(44)45-28)15-13-22-7-12-26(42-2)27(20-22)43-3/h4-12,14,20-21H,13,15-19H2,1-3H3/b28-21-InChIKey
RAHDQVDLRAZKHC-HFTWOUSFSA-NSynonyms
(5Z)3(2(34dimethoxyphenyl)ethyl)5((2(4(4methoxyphenyl)piperazin1yl)4oxopyrido(12a)pyrimidin3yl)methylidene)2sulfanylidene13thiazolidin4one
3((Z)(3(2(34dimethoxyphenyl)ethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(4(4methoxyphenyl)piperazin1yl)4Hpyrido(12a)pyrimidin4one
COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=O)N4C=CC=CC4=N3)C=C5C(=O)N(C(=S)S5)CCC6=CC(=C(C=C6)OC)OC
COc1ccc(cc1)N1CCN(CC1)c1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)CCc1ccc(c(c1)OC)OC
InChI=1SC33H33N5O5S2c1412410823(91124)35161836(191735)3025(31(39)371454629(37)3430)212832(40)38(33(44)4528)15132271226(422)27(2022)433h412142021H131519H213H3b2821
MFCD06651168
ZINC000097946696
ZINC97946696
Check stock
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Check stock on Vitas-MAvailable files
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