Vitas-M small molecule compound

3-{(Z)-[3-(2-chlorobenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(4-ethylpiperazin-1-yl)-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK542462
SMILES CCN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccccc1Cl

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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 C26H26ClN5O2S2 MW 540.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN5O2S2/c1-3-29-11-13-30(14-12-29)23-19(24(33)31-10-6-7-17(2)22(31)28-23)15-21-25(34)32(26(35)36-21)16-18-8-4-5-9-20(18)27/h4-10,15H,3,11-14,16H2,1-2H3/b21-15-
InChIKey
NWQKBUGNRYMRBA-QNGOZBTKSA-N
Synonyms
496799-04-3
(5Z)3((2CHLOROPHENYL)METHYL)5((2(4ETHYLPIPERAZIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(2chlorobenzyl)5((2(4ethylpiperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((2CHLOROPHENYL)METHYL)5((2(4ETHYLPIPERAZINYL)9METHYL4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
3((Z)(3(2chlorobenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(4ethylpiperazin1yl)9methyl4Hpyrido(12a)pyrimidin4one
496799043
CCN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)Cc1ccccc1Cl
CCN1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C4C(=O)N(C(=S)S4)CC5=CC=CC=C5Cl
InChI=1SC26H26ClN5O2S2c1329111330(141229)2319(24(33)31106717(2)22(31)2823)152125(34)32(26(35)3621)1618845920(18)27h41015H3111416H212H3b2115
MFCD03299090
ZINC000100878802
ZINC100878802

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Available files

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