Vitas-M small molecule compound
ethyl (2Z)-5-(2-methoxynaphthalen-1-yl)-2-{[5-(4-methylpiperazin-1-yl)furan-2-yl]methylidene}-3-oxo-7-propyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL436528
SMILES CCCC1=C(C(=O)OCC)C(n2c(=N1)s/c(=C\c1ccc(o1)N1CCN(CC1)C)/c2=O)c1c(OC)ccc2c1cccc2
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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 C33H36N4O5S MW 600.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H36N4O5S/c1-5-9-24-29(32(39)41-6-2)30(28-23-11-8-7-10-21(23)12-14-25(28)40-4)37-31(38)26(43-33(37)34-24)20-22-13-15-27(42-22)36-18-16-35(3)17-19-36/h7-8,10-15,20,30H,5-6,9,16-19H2,1-4H3/b26-20-InChIKey
OJNRFIYZFDHZDR-QOMWVZHYSA-NSynonyms
CCCC1=C(C(=O)OCC)C(n2c(=N1)sc(=Cc1ccc(o1)N1CCN(CC1)C)c2=O)c1c(OC)ccc2c1cccc2
CCCC1=C(C(N2C(=O)C(=CC3=CC=C(O3)N4CCN(CC4)C)SC2=N1)C5=C(C=CC6=CC=CC=C65)OC)C(=O)OCC
ethyl(2Z)5(2methoxynaphthalen1yl)2((5(4methylpiperazin1yl)furan2yl)methylidene)3oxo7propyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(2METHOXYNAPHTHALEN1YL)2((5(4METHYLPIPERAZIN1YL)FURAN2YL)METHYLIDENE)3OXO7PROPYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC33H36N4O5Sc1592429(32(39)4162)30(282311871021(23)121425(28)404)3731(38)26(4333(37)3424)2022131527(4222)36181635(3)171936h7810152030H5691619H214H3b2620
MFCD30711984
ZINC000101381506
ZINC000101381509
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.