Vitas-M small molecule compound

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

Catalog ID
STK544457
SMILES CCCCNc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCc1ccc(c(c1)OC)OC

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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 C27H30N4O4S2 MW 538.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O4S2/c1-5-6-12-28-23-19(25(32)30-13-7-8-17(2)24(30)29-23)16-22-26(33)31(27(36)37-22)14-11-18-9-10-20(34-3)21(15-18)35-4/h7-10,13,15-16,28H,5-6,11-12,14H2,1-4H3/b22-16-
InChIKey
JYSQKBAVLGIUCN-JWGURIENSA-N
Synonyms
488855-49-8
(5Z)5((2(BUTYLAMINO)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(2(34DIMETHOXYPHENYL)ETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(butylamino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(34dimethoxyphenethyl)2thioxothiazolidin4one
2(butylamino)3((Z)(3(2(34dimethoxyphenyl)ethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl4Hpyrido(12a)pyrimidin4one
3(2(34DIMETHOXYPHENYL)ETHYL)5((2(BUTYLAMINO)9METHYL4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
488855498
CCCCNC1=C(C(=O)N2C=CC=C(C2=N1)C)C=C3C(=O)N(C(=S)S3)CCC4=CC(=C(C=C4)OC)OC
CCCCNc1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)CCc1ccc(c(c1)OC)OC
InChI=1SC27H30N4O4S2c15612282319(25(32)30137817(2)24(30)2923)162226(33)31(27(36)3722)14111891020(343)21(1518)354h71013151628H56111214H214H3b2216
MFCD03294970
ZINC000100861303
ZINC100861303

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Available files

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