Vitas-M small molecule compound

(5Z)-1-acetyl-5-{[7-methoxy-2-(piperidin-1-yl)quinolin-3-yl]methylidene}-2-sulfanyl-1,5-dihydro-4H-imidazol-4-one

Catalog ID
STK560076
SMILES COc1ccc2c(c1)nc(c(c2)/C=C\1/C(=O)N=C(N1C(=O)C)S)N1CCCCC1

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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 C21H22N4O3S MW 410.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O3S/c1-13(26)25-18(20(27)23-21(25)29)11-15-10-14-6-7-16(28-2)12-17(14)22-19(15)24-8-4-3-5-9-24/h6-7,10-12H,3-5,8-9H2,1-2H3,(H,23,27,29)/b18-11-
InChIKey
FZMWPTPVQSLKBE-WQRHYEAKSA-N
Synonyms

(5Z)1acetyl5((7methoxy2(piperidin1yl)quinolin3yl)methylidene)2sulfanyl15dihydro4Himidazol4one
(5Z)1ACETYL5((7METHOXY2PIPERIDIN1YLQUINOLIN3YL)METHYLIDENE)2SULFANYLIDENEIMIDAZOLIDIN4ONE
CC(=O)N1C(=CC2=C(N=C3C=C(C=CC3=C2)OC)N4CCCCC4)C(=O)NC1=S
COc1ccc2c(c1)nc(c(c2)C=C1C(=O)N=C(N1C(=O)C)S)N1CCCCC1
InChI=1SC21H22N4O3Sc113(26)2518(20(27)2321(25)29)111510146716(282)1217(14)2219(15)248435924h671012H3589H212H3(H232729)b1811
MFCD03806879
ZINC000100769331
ZINC100769331

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Available files

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