Vitas-M small molecule compound
2-(4-chlorophenoxy)-3-[(Z)-(3-octyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK881385
SMILES CCCCCCCCN1C(=S)S/C(=C\c2c(Oc3ccc(cc3)Cl)nc3n(c2=O)cccc3)/C1=O
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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 C26H26ClN3O3S2 MW 528.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN3O3S2/c1-2-3-4-5-6-8-16-30-25(32)21(35-26(30)34)17-20-23(33-19-13-11-18(27)12-14-19)28-22-10-7-9-15-29(22)24(20)31/h7,9-15,17H,2-6,8,16H2,1H3/b21-17-InChIKey
LSRKRYWSKIEJNO-FXBPSFAMSA-NSynonyms
796877-18-4(5Z)5((2(4CHLOROPHENOXY)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3OCTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4chlorophenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3octyl2thioxothiazolidin4one
2(4chlorophenoxy)3((Z)(3octyl4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
796877184
CCCCCCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)OC4=CC=C(C=C4)Cl)SC1=S
CCCCCCCCN1C(=S)SC(=Cc2c(Oc3ccc(cc3)Cl)nc3n(c2=O)cccc3)C1=O
InChI=1SC26H26ClN3O3S2c1234568163025(32)21(3526(30)34)172023(3319131118(27)121419)282210791529(22)24(20)31h791517H26816H21H3b2117
MFCD03669111
ZINC000100932455
ZINC100932455
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