Vitas-M small molecule compound
9-methyl-3-{(Z)-[4-oxo-3-(propan-2-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK812339
SMILES CC(N1C(=S)S/C(=C\c2c(Oc3ccccc3)nc3n(c2=O)cccc3C)/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 C22H19N3O3S2 MW 437.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O3S2/c1-13(2)25-21(27)17(30-22(25)29)12-16-19(28-15-9-5-4-6-10-15)23-18-14(3)8-7-11-24(18)20(16)26/h4-13H,1-3H3/b17-12-InChIKey
SPZLIGOHWNFGIP-ATVHPVEESA-NSynonyms
(5Z)5((9METHYL4OXO2PHENOXYPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PROPAN2YL2SULFANYLIDENE13THIAZOLIDIN4ONE
9methyl3((Z)(4oxo3(propan2yl)2thioxo13thiazolidin5ylidene)methyl)2phenoxy4Hpyrido(12a)pyrimidin4one
CC(N1C(=S)SC(=Cc2c(Oc3ccccc3)nc3n(c2=O)cccc3C)C1=O)C
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)C(C)C)OC4=CC=CC=C4
InChI=1SC22H19N3O3S2c113(2)2521(27)17(3022(25)29)121619(281595461015)231814(3)871124(18)20(16)26h413H13H3b1712
MFCD03933172
ZINC000002520581
ZINC2520581
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