Vitas-M small molecule compound
6-(4-benzylpiperazin-1-yl)-5-{(Z)-[3-(4-fluorobenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
Catalog ID
STL049660
SMILES N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)Cc2ccc(cc2)F)c(n(c1=O)C)N1CCN(CC1)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 C30H28FN5O2S2 MW 573.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28FN5O2S2/c1-20-24(16-26-29(38)36(30(39)40-26)19-22-8-10-23(31)11-9-22)27(33(2)28(37)25(20)17-32)35-14-12-34(13-15-35)18-21-6-4-3-5-7-21/h3-11,16H,12-15,18-19H2,1-2H3/b26-16-InChIKey
GEPBGOYZXIHAJM-QQXSKIMKSA-NSynonyms
(Z)6(4benzylpiperazin1yl)5((3(4fluorobenzyl)4oxo2thioxothiazolidin5ylidene)methyl)14dimethyl2oxo12dihydropyridine3carbonitrile
6(4BENZYLPIPERAZIN1YL)5((Z)(3((4FLUOROPHENYL)METHYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)14DIMETHYL2OXOPYRIDINE3CARBONITRILE
6(4benzylpiperazin1yl)5((Z)(3(4fluorobenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)14dimethyl2oxo12dihydropyridine3carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CC3=CC=C(C=C3)F)N4CCN(CC4)CC5=CC=CC=C5)C)C#N
InChI=1SC30H28FN5O2S2c12024(162629(38)36(30(39)4026)192281023(31)11922)27(33(2)28(37)25(20)1732)35141234(131535)18216435721h31116H12151819H212H3b2616
MFCD03693093
N#Cc1c(C)c(C=C2SC(=S)N(C2=O)Cc2ccc(cc2)F)c(n(c1=O)C)N1CCN(CC1)Cc1ccccc1
ZINC000097947514
ZINC97947514
Check stock
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