Vitas-M small molecule compound
2-(4-benzylpiperazin-1-yl)-7-methyl-3-[(Z)-(4-oxo-3-propyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK876363
SMILES CCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)Cc2ccccc2)/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 C27H29N5O2S2 MW 519.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O2S2/c1-3-11-31-26(34)22(36-27(31)35)16-21-24(28-23-10-9-19(2)17-32(23)25(21)33)30-14-12-29(13-15-30)18-20-7-5-4-6-8-20/h4-10,16-17H,3,11-15,18H2,1-2H3/b22-16-InChIKey
ZZZRRSLLBHPBBF-JWGURIENSA-NSynonyms
(5Z)5((2(4BENZYLPIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PROPYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4benzylpiperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3propyl2thioxothiazolidin4one
2(4benzylpiperazin1yl)7methyl3((Z)(4oxo3propyl2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CCCN1C(=O)C(=CC2=C(N=C3C=CC(=CN3C2=O)C)N4CCN(CC4)CC5=CC=CC=C5)SC1=S
CCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)Cc2ccccc2)C1=O
InChI=1SC27H29N5O2S2c13113126(34)22(3627(31)35)162124(282310919(2)1732(23)25(21)33)30141229(131530)18207546820h4101617H3111518H212H3b2216
MFCD02990633
ZINC000019996376
ZINC19996376
Check stock
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Check stock on Vitas-MAvailable files
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