Vitas-M small molecule compound

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

Catalog ID
STL363478
SMILES CCOC(=O)N1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C

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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 C21H23N5O4S2 MW 473.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O4S2/c1-4-30-20(29)25-10-8-24(9-11-25)17-14(12-15-19(28)23(3)21(31)32-15)18(27)26-7-5-6-13(2)16(26)22-17/h5-7,12H,4,8-11H2,1-3H3/b15-12-
InChIKey
WUZMVCMNMVVEOK-QINSGFPZSA-N
Synonyms
607692-37-5
(Z)ethyl4(9methyl3((3methyl4oxo2thioxothiazolidin5ylidene)methyl)4oxo4Hpyrido(12a)pyrimidin2yl)piperazine1carboxylate
607692375
CCOC(=O)N1CCN(CC1)c1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)C
CCOC(=O)N1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C4C(=O)N(C(=S)S4)C
ETHYL4(9METHYL3((3METHYL4OXO2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)4OXO5HYDROPYRIDINO(12A)PYRIMIDIN2YL)PIPERAZINECARBOXYLATE
ETHYL4(9METHYL3((Z)(3METHYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)4OXOPYRIDO(12A)PYRIMIDIN2YL)PIPERAZINE1CARBOXYLATE
ethyl4(9methyl3((Z)(3methyl4oxo2thioxo13thiazolidin5ylidene)methyl)4oxo4Hpyrido(12a)pyrimidin2yl)piperazine1carboxylate
InChI=1SC21H23N5O4S2c143020(29)2510824(91125)1714(121519(28)23(3)21(31)3215)18(27)2675613(2)16(26)2217h5712H4811H213H3b1512
MFCD03664446
ZINC000001447001
ZINC1447001

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Available files

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