Vitas-M small molecule compound
ethyl (1-{3-[(Z)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}-3-oxopiperazin-2-yl)acetate
Catalog ID
STK982901
SMILES CCOC(=O)CC1C(=O)NCCN1c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CC
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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 C23H25N5O5S2 MW 515.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O5S2/c1-4-26-22(32)16(35-23(26)34)11-14-19(25-18-13(3)7-6-9-28(18)21(14)31)27-10-8-24-20(30)15(27)12-17(29)33-5-2/h6-7,9,11,15H,4-5,8,10,12H2,1-3H3,(H,24,30)/b16-11-InChIKey
AMZFJNMGTHMAMT-WJDWOHSUSA-NSynonyms
(Z)ethyl2(1(3((3ethyl4oxo2thioxothiazolidin5ylidene)methyl)9methyl4oxo4Hpyrido(12a)pyrimidin2yl)3oxopiperazin2yl)acetate
CCN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)N4CCNC(=O)C4CC(=O)OCC)SC1=S
CCOC(=O)CC1C(=O)NCCN1c1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)CC
ethyl(1(3((Z)(3ethyl4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl4oxo4Hpyrido(12a)pyrimidin2yl)3oxopiperazin2yl)acetate
ETHYL2(1(3((Z)(3ETHYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN2YL)3OXOPIPERAZIN2YL)ACETATE
InChI=1SC23H25N5O5S2c142622(32)16(3523(26)34)111419(251813(3)76928(18)21(14)31)271082420(30)15(27)1217(29)3352h6791115H4581012H213H3(H2430)b1611
MFCD03303912
ZINC000002357233
ZINC000002520537
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.