Vitas-M small molecule compound

2-(4-benzylpiperidin-1-yl)-3-{(Z)-[3-(3-methoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK810170
SMILES COCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCC(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 C29H32N4O3S2 MW 548.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N4O3S2/c1-20-9-10-25-30-26(31-14-11-22(12-15-31)17-21-7-4-3-5-8-21)23(27(34)33(25)19-20)18-24-28(35)32(29(37)38-24)13-6-16-36-2/h3-5,7-10,18-19,22H,6,11-17H2,1-2H3/b24-18-
InChIKey
HAQXJNCBYHDMRL-MOHJPFBDSA-N
Synonyms
370586-60-0
(5Z)5((2(4BENZYLPIPERIDIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(3METHOXYPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4benzylpiperidin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(3methoxypropyl)2thioxothiazolidin4one
2(4benzylpiperidin1yl)3((Z)(3(3methoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)7methyl4Hpyrido(12a)pyrimidin4one
3(3METHOXYPROPYL)5((7METHYL4OXO2(4BENZYLPIPERIDYL)(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
370586600
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCCOC)N4CCC(CC4)CC5=CC=CC=C5)C=C1
COCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCC(CC2)Cc2ccccc2)C1=O
InChI=1SC29H32N4O3S2c120910253026(31141122(121531)17217435821)23(27(34)33(25)1920)182428(35)32(29(37)3824)13616362h35710181922H61117H212H3b2418
MFCD03006596
ZINC000100807744
ZINC100807744

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Available files

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