Vitas-M small molecule compound
5-(azepan-1-yl)-2-[(E)-{3-[2-(4-methoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]-1,3-oxazole-4-carbonitrile
Catalog ID
STK707405
SMILES N#Cc1nc(oc1N1CCCCCC1)/C=C\1/SC(=S)N(C1=O)CCc1ccc(cc1)OC
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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 C23H24N4O3S2 MW 468.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O3S2/c1-29-17-8-6-16(7-9-17)10-13-27-21(28)19(32-23(27)31)14-20-25-18(15-24)22(30-20)26-11-4-2-3-5-12-26/h6-9,14H,2-5,10-13H2,1H3/b19-14+InChIKey
LXHXLJGHEWOCQQ-XMHGGMMESA-NSynonyms
845653-21-6(E)5(azepan1yl)2((3(4methoxyphenethyl)4oxo2thioxothiazolidin5ylidene)methyl)oxazole4carbonitrile
5(AZEPAN1YL)2((E)(3(2(4METHOXYPHENYL)ETHYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)13OXAZOLE4CARBONITRILE
5(azepan1yl)2((E)(3(2(4methoxyphenyl)ethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)13oxazole4carbonitrile
845653216
COC1=CC=C(C=C1)CCN2C(=O)C(=CC3=NC(=C(O3)N4CCCCCC4)C#N)SC2=S
InChI=1SC23H24N4O3S2c129178616(7917)10132721(28)19(3223(27)31)14202518(1524)22(3020)261142351226h6914H251013H21H3b1914+
MFCD04167972
N#Cc1nc(oc1N1CCCCCC1)C=C1SC(=S)N(C1=O)CCc1ccc(cc1)OC
ZINC000009281577
ZINC09281577
ZINC9281577
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