Vitas-M small molecule compound
2-{[3-(1H-imidazol-1-yl)propyl]amino}-9-methyl-3-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK876761
SMILES C=CCN1C(=S)S/C(=C\c2c(NCCCn3cncc3)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 C22H22N6O2S2 MW 466.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O2S2/c1-3-9-28-21(30)17(32-22(28)31)13-16-18(24-7-5-10-26-12-8-23-14-26)25-19-15(2)6-4-11-27(19)20(16)29/h3-4,6,8,11-14,24H,1,5,7,9-10H2,2H3/b17-13-InChIKey
MYXCEBCMHHBQMH-LGMDPLHJSA-NSynonyms
374547-83-8(5Z)5((2(3IMIDAZOL1YLPROPYLAMINO)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2((3(1Himidazol1yl)propyl)amino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3allyl2thioxothiazolidin4one
2((3(1Himidazol1yl)propyl)amino)9methyl3((Z)(4oxo3(prop2en1yl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
374547838
C=CCN1C(=S)SC(=Cc2c(NCCCn3cncc3)nc3n(c2=O)cccc3C)C1=O
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CC=C)NCCCN4C=CN=C4
InChI=1SC22H22N6O2S2c1392821(30)17(3222(28)31)131618(24751026128231426)251915(2)641127(19)20(16)29h3468111424H157910H22H3b1713
MFCD01956421
ZINC000009327448
ZINC9327448
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