Vitas-M small molecule compound
(5E)-5-({1-[3-(4-methylphenoxy)propyl]-1H-indol-3-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK084522
SMILES S=C1NC(=O)/C(=C\c2cn(c3c2cccc3)CCCOc2ccc(cc2)C)/S1
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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 C22H20N2O2S2 MW 408.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O2S2/c1-15-7-9-17(10-8-15)26-12-4-11-24-14-16(18-5-2-3-6-19(18)24)13-20-21(25)23-22(27)28-20/h2-3,5-10,13-14H,4,11-12H2,1H3,(H,23,25,27)/b20-13+InChIKey
KDGJNQLETSOPEJ-DEDYPNTBSA-NSynonyms
(5E)5((1(3(4METHYLPHENOXY)PROPYL)1HINDOL3YL)METHYLIDENE)2THIOXO13THIAZOLIDIN4ONE
(5E)5((1(3(4METHYLPHENOXY)PROPYL)INDOL3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
CC1=CC=C(C=C1)OCCCN2C=C(C3=CC=CC=C32)C=C4C(=O)NC(=S)S4
InChI=1SC22H20N2O2S2c1157917(10815)2612411241416(18523619(18)24)132021(25)2322(27)2820h235101314H41112H21H3(H232527)b2013+
MFCD03138119
S=C1NC(=O)C(=Cc2cn(c3c2cccc3)CCCOc2ccc(cc2)C)S1
STK084522
ZINC000002851929
ZINC02851929
ZINC2851929
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