Vitas-M small molecule compound
5-(azepan-1-yl)-2-[(E)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1,3-oxazole-4-carbonitrile
Catalog ID
STK707401
SMILES N#Cc1nc(oc1N1CCCCCC1)/C=C\1/SC(=S)N(C1=O)Cc1ccccc1
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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 C21H20N4O2S2 MW 424.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O2S2/c22-13-16-20(24-10-6-1-2-7-11-24)27-18(23-16)12-17-19(26)25(21(28)29-17)14-15-8-4-3-5-9-15/h3-5,8-9,12H,1-2,6-7,10-11,14H2/b17-12+InChIKey
YKMIYKYMPZUHOB-SFQUDFHCSA-NSynonyms
848752-29-4(E)5(azepan1yl)2((3benzyl4oxo2thioxothiazolidin5ylidene)methyl)oxazole4carbonitrile
5(AZEPAN1YL)2((E)(3BENZYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)13OXAZOLE4CARBONITRILE
5(azepan1yl)2((E)(3benzyl4oxo2thioxo13thiazolidin5ylidene)methyl)13oxazole4carbonitrile
848752294
C1CCCN(CC1)C2=C(N=C(O2)C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4)C#N
InChI=1SC21H20N4O2S2c22131620(241061271124)2718(2316)121719(26)25(21(28)2917)14158435915h358912H1267101114H2b1712+
MFCD04196350
N#Cc1nc(oc1N1CCCCCC1)C=C1SC(=S)N(C1=O)Cc1ccccc1
ZINC000009210285
ZINC09210285
ZINC9210285
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