Vitas-M small molecule compound

1-(4-oxo-3-{(Z)-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxamide

Catalog ID
STK616707
SMILES NC(=O)C1CCN(CC1)c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCc1ccccc1

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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 C26H25N5O3S2 MW 519.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O3S2/c27-22(32)18-10-13-29(14-11-18)23-19(24(33)30-12-5-4-8-21(30)28-23)16-20-25(34)31(26(35)36-20)15-9-17-6-2-1-3-7-17/h1-8,12,16,18H,9-11,13-15H2,(H2,27,32)/b20-16-
InChIKey
XNUVFJZJMLEAPW-SILNSSARSA-N
Synonyms
607704-30-3
(Z)1(4oxo3((4oxo3phenethyl2thioxothiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin2yl)piperidine4carboxamide
1(4oxo3((Z)(4oxo3(2phenylethyl)2sulfanylidene13thiazolidin5ylidene)methyl)pyrido(12a)pyrimidin2yl)piperidine4carboxamide
1(4oxo3((Z)(4oxo3(2phenylethyl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin2yl)piperidine4carboxamide
1(4OXO3((Z)(4OXO3PHENETHYL2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PYRIDO(12A)PYRIMIDIN2YL)PIPERIDINE4CARBOXAMIDE
607704303
C1CN(CCC1C(=O)N)C2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)CCC5=CC=CC=C5
InChI=1SC26H25N5O3S2c2722(32)18101329(141118)2319(24(33)301254821(30)2823)162025(34)31(26(35)3620)159176213717h18121618H9111315H2(H22732)b2016
MFCD03667374
NC(=O)C1CCN(CC1)c1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)CCc1ccccc1
ZINC000002194679
ZINC2194679

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Available files

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