Vitas-M small molecule compound

2-[4-(4-chlorophenoxy)phenyl]-8-methoxy-4,4-dimethyl-4,5-dihydro[1,2]thiazolo[5,4-c]quinoline-1(2H)-thione

Catalog ID
STK044146
SMILES COc1ccc2c(c1)c1c(=S)n(sc1C(N2)(C)C)c1ccc(cc1)Oc1ccc(cc1)Cl

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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 C25H21ClN2O2S2 MW 481.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN2O2S2/c1-25(2)23-22(20-14-19(29-3)12-13-21(20)27-25)24(31)28(32-23)16-6-10-18(11-7-16)30-17-8-4-15(26)5-9-17/h4-14,27H,1-3H3
InChIKey
OCJKOMIQCMUPPJ-UHFFFAOYSA-N
Synonyms
328072-79-3
2(4(4CHLOROPHENOXY)PHENYL)8METHOXY44DIMETHYL245TRIHYDROISOTHIAZOLO(54C)QUINOLINE1THIONE
2(4(4CHLOROPHENOXY)PHENYL)8METHOXY44DIMETHYL45DIHYDRO(12)THIAZOLO(54C)QUINOLINE1(2H)THIONE
2(4(4chlorophenoxy)phenyl)8methoxy44dimethyl45dihydroisothiazolo(54c)quinoline1(2H)thione
2(4(4CHLOROPHENOXY)PHENYL)8METHOXY44DIMETHYL5H(12)THIAZOLO(54C)QUINOLINE1THIONE
328072793
CC1(C2=C(C3=C(N1)C=CC(=C3)OC)C(=S)N(S2)C4=CC=C(C=C4)OC5=CC=C(C=C5)Cl)C
COc1ccc2c(c1)c1c(=S)n(sc1C(N2)(C)C)c1ccc(cc1)Oc1ccc(cc1)Cl
InChI=1SC25H21ClN2O2S2c125(2)2322(201419(293)121321(20)2725)24(31)28(3223)1661018(11716)30178415(26)5917h41427H13H3
MFCD01171513
STK044146
ZINC000008440429
ZINC08440429
ZINC8440429

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.