Vitas-M small molecule compound

2-[(3-ethoxypropyl)amino]-3-{(Z)-[3-(2-methoxyethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK616567
SMILES COCCN1C(=S)S/C(=C\c2c(NCCCOCC)nc3n(c2=O)cccc3C)/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 C21H26N4O4S2 MW 462.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O4S2/c1-4-29-11-6-8-22-17-15(19(26)24-9-5-7-14(2)18(24)23-17)13-16-20(27)25(10-12-28-3)21(30)31-16/h5,7,9,13,22H,4,6,8,10-12H2,1-3H3/b16-13-
InChIKey
XMYOISHVZVOPEZ-SSZFMOIBSA-N
Synonyms
617684-78-3
(5Z)5((2(3ETHOXYPROPYLAMINO)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(2METHOXYETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2((3ethoxypropyl)amino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(2methoxyethyl)2thioxothiazolidin4one
2((3ethoxypropyl)amino)3((Z)(3(2methoxyethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl4Hpyrido(12a)pyrimidin4one
5((2((3ETHOXYPROPYL)AMINO)9METHYL4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)3(2METHOXYETHYL)2THIOXO13THIAZOLIDIN4ONE
617684783
CCOCCCNC1=C(C(=O)N2C=CC=C(C2=N1)C)C=C3C(=O)N(C(=S)S3)CCOC
COCCN1C(=S)SC(=Cc2c(NCCCOCC)nc3n(c2=O)cccc3C)C1=O
InChI=1SC21H26N4O4S2c14291168221715(19(26)2495714(2)18(24)2317)131620(27)25(1012283)21(30)3116h5791322H4681012H213H3b1613
MFCD03665011
ZINC000008827824
ZINC8827824

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Available files

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