Vitas-M small molecule compound

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

Catalog ID
STL363413
SMILES COc1ccc(cc1)CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCCCC2)/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 C27H28N4O3S2 MW 520.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O3S2/c1-18-7-6-15-30-23(18)28-24(29-13-4-3-5-14-29)21(25(30)32)17-22-26(33)31(27(35)36-22)16-12-19-8-10-20(34-2)11-9-19/h6-11,15,17H,3-5,12-14,16H2,1-2H3/b22-17-
InChIKey
FMIOBOUGAVSQFO-XLNRJJMWSA-N
Synonyms
615275-24-6
(5Z)3(2(4METHOXYPHENYL)ETHYL)5((9METHYL4OXO2PIPERIDIN1YLPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(4methoxyphenethyl)5((9methyl4oxo2(piperidin1yl)4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(2(4methoxyphenyl)ethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl2(piperidin1yl)4Hpyrido(12a)pyrimidin4one
3(2(4METHOXYPHENYL)ETHYL)5((9METHYL4OXO2PIPERIDYL(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
615275246
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCC4=CC=C(C=C4)OC)N5CCCCC5
COc1ccc(cc1)CCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCCCC2)C1=O
InChI=1SC27H28N4O3S2c11876153023(18)2824(29134351429)21(25(30)32)172226(33)31(27(35)3622)16121981020(342)11919h6111517H35121416H212H3b2217
MFCD03663815
ZINC000001482213
ZINC1482213

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Available files

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