Vitas-M small molecule compound
2-{(E)-[3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-5-(morpholin-4-yl)-1,3-oxazole-4-carbonitrile
Catalog ID
STK906486
SMILES N#Cc1nc(oc1N1CCOCC1)/C=C\1/SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2
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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 C20H16N4O5S2 MW 456.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O5S2/c21-9-13-19(23-3-5-26-6-4-23)29-17(22-13)8-16-18(25)24(20(30)31-16)10-12-1-2-14-15(7-12)28-11-27-14/h1-2,7-8H,3-6,10-11H2/b16-8+InChIKey
GXAOBPMXBDEJNY-LZYBPNLTSA-NSynonyms
1019776-38-5(E)2((3(benzo(d)(13)dioxol5ylmethyl)4oxo2thioxothiazolidin5ylidene)methyl)5morpholinooxazole4carbonitrile
1019776385
2((3(2HBENZO(34D)13DIOXOLEN5YLMETHYL)4OXO2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)5MORPHOLIN4YL13OXAZOLE4CARBONITRILE
2((E)(3(13BENZODIOXOL5YLMETHYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)5MORPHOLIN4YL13OXAZOLE4CARBONITRILE
2((E)(3(13benzodioxol5ylmethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)5(morpholin4yl)13oxazole4carbonitrile
C1COCCN1C2=C(N=C(O2)C=C3C(=O)N(C(=S)S3)CC4=CC5=C(C=C4)OCO5)C#N
InChI=1SC20H16N4O5S2c2191319(2335266423)2917(2213)81618(25)24(20(30)3116)1012121415(712)28112714h1278H361011H2b168+
MFCD04189786
N#Cc1nc(oc1N1CCOCC1)C=C1SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2
ZINC000013778911
ZINC13778911
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