Vitas-M small molecule compound

(5Z)-3-ethyl-5-({1-[4-(4-methoxyphenoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl}methylidene)-1-methyl-2-thioxoimidazolidin-4-one

Catalog ID
STK118244
SMILES COc1ccc(cc1)Oc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=O)N(C(=S)N1C)CC

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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 C26H27N3O3S MW 461.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O3S/c1-6-28-25(30)24(27(4)26(28)33)16-19-15-17(2)29(18(19)3)20-7-9-22(10-8-20)32-23-13-11-21(31-5)12-14-23/h7-16H,6H2,1-5H3/b24-16-
InChIKey
DDVZKRZPAXTAAI-JLPGSUDCSA-N
Synonyms

(5Z)3ETHYL5((1(4(4METHOXYPHENOXY)PHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)1METHYL2THIOXOIMIDAZOLIDIN4ONE
(5Z)3ETHYL5((1(4(4METHOXYPHENOXY)PHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1METHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
CCN1C(=O)C(=CC2=C(N(C(=C2)C)C3=CC=C(C=C3)OC4=CC=C(C=C4)OC)C)N(C1=S)C
COc1ccc(cc1)Oc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)N(C(=S)N1C)CC
InChI=1SC26H27N3O3Sc162825(30)24(27(4)26(28)33)16191517(2)29(18(19)3)207922(10820)3223131121(315)121423h716H6H215H3b2416
MFCD04127983
ZINC000009805526
ZINC09805526
ZINC9805526

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Available files

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