Vitas-M small molecule compound

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

Catalog ID
STK812989
SMILES CCN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCCC(=O)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 C23H27N5O4S2 MW 501.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5O4S2/c1-3-25-10-12-26(13-11-25)20-16(21(31)27-8-4-6-15(2)19(27)24-20)14-17-22(32)28(23(33)34-17)9-5-7-18(29)30/h4,6,8,14H,3,5,7,9-13H2,1-2H3,(H,29,30)/b17-14-
InChIKey
OFIZQGAOBHYMFW-VKAVYKQESA-N
Synonyms
609794-28-7
4((5Z)5((2(4ethylpiperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
4((5Z)5((2(4ETHYLPIPERAZIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
4(5((2(4ETHYLPIPERAZIN1YL)9METHYL4OXO4HPYRIDO(12A)PYRIMIDIN3YL)METHYLENE)4OXO2THIOXOTHIAZOLIDIN3YL)BUTANOICACID
609794287
CCN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)CCCC(=O)O
CCN1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C4C(=O)N(C(=S)S4)CCCC(=O)O
InChI=1SC23H27N5O4S2c1325101226(131125)2016(21(31)2784615(2)19(27)2420)141722(32)28(23(33)3417)95718(29)30h46814H357913H212H3(H2930)b1714
MFCD04441100
ZINC000008872585
ZINC8872585

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Available files

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