Vitas-M small molecule compound

11-[(5Z)-5-{[9-methyl-4-oxo-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]undecanoic acid

Catalog ID
STK822614
SMILES OC(=O)CCCCCCCCCCN1C(=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 C29H38N4O4S2 MW 570.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H38N4O4S2/c1-21-14-13-19-32-25(21)30-26(31-16-10-8-11-17-31)22(27(32)36)20-23-28(37)33(29(38)39-23)18-12-7-5-3-2-4-6-9-15-24(34)35/h13-14,19-20H,2-12,15-18H2,1H3,(H,34,35)/b23-20-
InChIKey
YQYPHMGFQZKECC-ATJXCDBQSA-N
Synonyms
477734-65-9
11((5Z)5((9methyl4oxo2(piperidin1yl)4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)undecanoicacid
11((5Z)5((9METHYL4OXO2PIPERIDIN1YLPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)UNDECANOICACID
11(5((9METHYL4OXO2(PIPERIDIN1YL)4HPYRIDO(12A)PYRIMIDIN3YL)METHYLENE)4OXO2THIOXOTHIAZOLIDIN3YL)UNDECANOICACID
477734659
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCCCCCCCCCC(=O)O)N4CCCCC4
InChI=1SC29H38N4O4S2c1211413193225(21)3026(3116108111731)22(27(32)36)202328(37)33(29(38)3923)181275324691524(34)35h13141920H2121518H21H3(H3435)b2320
MFCD03212228
OC(=O)CCCCCCCCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCCCC2)C1=O
ZINC000101333885
ZINC101333885

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Available files

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