Vitas-M small molecule compound

(5Z)-5-{[3-(4-methoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(2-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK800956
SMILES COc1ccc(cc1C)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1ccccc1C)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 C29H23N5O2S MW 505.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N5O2S/c1-18-9-7-8-12-23(18)27-30-29-34(32-27)28(35)25(37-29)16-21-17-33(22-10-5-4-6-11-22)31-26(21)20-13-14-24(36-3)19(2)15-20/h4-17H,1-3H3/b25-16-
InChIKey
ARPDNOQITJDOPE-XYGWBWBKSA-N
Synonyms
956783-88-3
(5Z)5((3(4methoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)2(2methylphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((3(4METHOXY3METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2(2METHYLPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)5((3(4methoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylene)2(otolyl)thiazolo(32b)(124)triazol6(5H)one
956783883
CC1=CC=CC=C1C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC(=C(C=C5)OC)C)C6=CC=CC=C6)SC3=N2
COc1ccc(cc1C)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1ccccc1C)c1ccccc1
InChI=1SC29H23N5O2Sc1189781223(18)27302934(3227)28(35)25(3729)16211733(22105461122)3126(21)20131424(363)19(2)1520h417H13H3b2516
MFCD04011221
ZINC000002373941
ZINC02373941
ZINC2373941

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Available files

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