Vitas-M small molecule compound

(2Z)-2-cyano-N-(furan-2-ylmethyl)-2-{(5E)-4-oxo-5-[4-(pentyloxy)benzylidene]-3-phenyl-1,3-thiazolidin-2-ylidene}ethanamide

Catalog ID
STK740530
SMILES CCCCCOc1ccc(cc1)/C=c\1/s/c(=C(\C(=O)NCc2ccco2)/C#N)/n(c1=O)c1ccccc1

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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 C29H27N3O4S MW 513.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N3O4S/c1-2-3-7-16-35-23-14-12-21(13-15-23)18-26-28(34)32(22-9-5-4-6-10-22)29(37-26)25(19-30)27(33)31-20-24-11-8-17-36-24/h4-6,8-15,17-18H,2-3,7,16,20H2,1H3,(H,31,33)/b26-18+,29-25-
InChIKey
CQXACDBGCVURCV-IMIYWQHTSA-N
Synonyms

(2Z)2CYANON(FURAN2YLMETHYL)2((5E)4OXO5((4PENTOXYPHENYL)METHYLIDENE)3PHENYL13THIAZOLIDIN2YLIDENE)ACETAMIDE
(2Z)2cyanoN(furan2ylmethyl)2((5E)4oxo5(4(pentyloxy)benzylidene)3phenyl13thiazolidin2ylidene)ethanamide
(Z)2cyanoN(furan2ylmethyl)2((Z)4oxo5(4(pentyloxy)benzylidene)3phenylthiazolidin2ylidene)acetamide
2CYANON(2FURYLMETHYL)2(4OXO5((4PENTYLOXYPHENYL)METHYLENE)3PHENYL(13THIAZOLIDIN2YLIDENE))ACETAMIDE
CCCCCOC1=CC=C(C=C1)C=C2C(=O)N(C(=C(C#N)C(=O)NCC3=CC=CO3)S2)C4=CC=CC=C4
CCCCCOc1ccc(cc1)C=c1sc(=C(C(=O)NCc2ccco2)C#N)n(c1=O)c1ccccc1
InChI=1SC29H27N3O4Sc1237163523141221(131523)182628(34)32(2295461022)29(3726)25(1930)27(33)312024118173624h468151718H2371620H21H3(H3133)b2618+2925
MFCD06438362
ZINC000002226189
ZINC02226189
ZINC2226189

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Available files

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