Vitas-M small molecule compound
9-methyl-3-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK812344
SMILES C=CCN1C(=S)S/C(=C\c2c(Oc3ccccc3)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 C22H17N3O3S2 MW 435.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O3S2/c1-3-11-25-21(27)17(30-22(25)29)13-16-19(28-15-9-5-4-6-10-15)23-18-14(2)8-7-12-24(18)20(16)26/h3-10,12-13H,1,11H2,2H3/b17-13-InChIKey
DCELVEPGCRVXOO-LGMDPLHJSA-NSynonyms
(5Z)5((9METHYL4OXO2PHENOXYPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
9methyl3((Z)(4oxo3(prop2en1yl)2thioxo13thiazolidin5ylidene)methyl)2phenoxy4Hpyrido(12a)pyrimidin4one
C=CCN1C(=S)SC(=Cc2c(Oc3ccccc3)nc3n(c2=O)cccc3C)C1=O
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CC=C)OC4=CC=CC=C4
InChI=1SC22H17N3O3S2c13112521(27)17(3022(25)29)131619(281595461015)231814(2)871224(18)20(16)26h3101213H111H22H3b1713
MFCD03933173
ZINC000016728836
ZINC16728836
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