Vitas-M small molecule compound

3-{(Z)-[3-(1,1-dioxidotetrahydrothiophen-3-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-2-{[3-(propan-2-yloxy)propyl]amino}-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK903673
SMILES CC(OCCCNc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCS(=O)(=O)C1)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 C23H28N4O5S3 MW 536.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O5S3/c1-14(2)32-10-5-8-24-19-17(21(28)26-9-4-6-15(3)20(26)25-19)12-18-22(29)27(23(33)34-18)16-7-11-35(30,31)13-16/h4,6,9,12,14,16,24H,5,7-8,10-11,13H2,1-3H3/b18-12-
InChIKey
OCSMODLSGAFSKS-PDGQHHTCSA-N
Synonyms
799840-35-0
(5Z)3(11DIOXOTHIOLAN3YL)5((9METHYL4OXO2(3PROPAN2YLOXYPROPYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(11dioxidotetrahydrothiophen3yl)5((2((3isopropoxypropyl)amino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(11dioxidotetrahydrothiophen3yl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl2((3(propan2yloxy)propyl)amino)4Hpyrido(12a)pyrimidin4one
799840350
CC(OCCCNc1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)C1CCS(=O)(=O)C1)C
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)C4CCS(=O)(=O)C4)NCCCOC(C)C
InChI=1SC23H28N4O5S3c114(2)321058241917(21(28)2694615(3)20(26)2519)121822(29)27(23(33)3418)1671135(3031)1316h46912141624H578101113H213H3b1812
MFCD03686236
ZINC000101002948
ZINC000101002951

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Available files

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