Vitas-M small molecule compound
2-(4-benzylpiperidin-1-yl)-3-{(Z)-[3-(2-chlorobenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK799563
SMILES S=C1S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCC(CC2)Cc2ccccc2)/C(=O)N1Cc1ccccc1Cl
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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 C31H27ClN4O2S2 MW 587.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27ClN4O2S2/c32-25-11-5-4-10-23(25)20-36-30(38)26(40-31(36)39)19-24-28(33-27-12-6-7-15-35(27)29(24)37)34-16-13-22(14-17-34)18-21-8-2-1-3-9-21/h1-12,15,19,22H,13-14,16-18,20H2/b26-19-InChIKey
CQFGAOSPLCGCCN-XHPQRKPJSA-NSynonyms
(5Z)5((2(4BENZYLPIPERIDIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3((2CHLOROPHENYL)METHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
2(4benzylpiperidin1yl)3((Z)(3(2chlorobenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
C1CN(CCC1CC2=CC=CC=C2)C3=C(C(=O)N4C=CC=CC4=N3)C=C5C(=O)N(C(=S)S5)CC6=CC=CC=C6Cl
InChI=1SC31H27ClN4O2S2c322511541023(25)203630(38)26(4031(36)39)192428(332712671535(27)29(24)37)34161322(141734)18218213921h112151922H1314161820H2b2619
MFCD06642799
S=C1SC(=Cc2c(nc3n(c2=O)cccc3)N2CCC(CC2)Cc2ccccc2)C(=O)N1Cc1ccccc1Cl
ZINC000097946695
ZINC97946695
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