Vitas-M small molecule compound

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

Catalog ID
STK876573
SMILES COCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCC(CC2)C)/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 C23H28N4O3S2 MW 472.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O3S2/c1-15-7-10-25(11-8-15)20-17(21(28)27-14-16(2)5-6-19(27)24-20)13-18-22(29)26(23(31)32-18)9-4-12-30-3/h5-6,13-15H,4,7-12H2,1-3H3/b18-13-
InChIKey
OFJSBSUSDQYNSP-AQTBWJFISA-N
Synonyms
381695-58-5
(5Z)3(3METHOXYPROPYL)5((7METHYL2(4METHYLPIPERIDIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(3methoxypropyl)5((7methyl2(4methylpiperidin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((3(3METHOXYPROPYL)4OXO2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)7METHYL2(4METHYL1PIPERIDINYL)4HPYRIDO(12A)PYRIMIDIN4ONE
3((Z)(3(3methoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)7methyl2(4methylpiperidin1yl)4Hpyrido(12a)pyrimidin4one
381695585
CC1CCN(CC1)C2=C(C(=O)N3C=C(C=CC3=N2)C)C=C4C(=O)N(C(=S)S4)CCCOC
COCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCC(CC2)C)C1=O
InChI=1SC23H28N4O3S2c11571025(11815)2017(21(28)271416(2)5619(27)2420)131822(29)26(23(31)3218)9412303h561315H4712H213H3b1813
MFCD02977889
ZINC000001815607
ZINC01815607
ZINC1815607

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.