Vitas-M small molecule compound
7-methyl-3-{(Z)-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(prop-2-en-1-ylamino)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK815083
SMILES C=CCNc1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CC1CCCO1)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 C21H22N4O3S2 MW 442.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O3S2/c1-3-8-22-18-15(19(26)24-11-13(2)6-7-17(24)23-18)10-16-20(27)25(21(29)30-16)12-14-5-4-9-28-14/h3,6-7,10-11,14,22H,1,4-5,8-9,12H2,2H3/b16-10-InChIKey
KAAMLGIDDFLGRS-YBEGLDIGSA-NSynonyms
(5Z)5((7METHYL4OXO2(PROP2ENYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(OXOLAN2YLMETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
7methyl3((Z)(4oxo3(tetrahydrofuran2ylmethyl)2thioxo13thiazolidin5ylidene)methyl)2(prop2en1ylamino)4Hpyrido(12a)pyrimidin4one
C=CCNc1nc2ccc(cn2c(=O)c1C=C1SC(=S)N(C1=O)CC1CCCO1)C
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CC4CCCO4)NCC=C)C=C1
InChI=1SC21H22N4O3S2c138221815(19(26)241113(2)6717(24)2318)101620(27)25(21(29)3016)12145492814h36710111422H1458912H22H3b1610
MFCD04442480
ZINC000016732044
ZINC000016732047
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