Vitas-M small molecule compound

2-[(5Z)-6-oxo-5-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methylidene}-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]phenyl acetate

Catalog ID
STK983064
SMILES CC(=O)Oc1ccccc1c1nc2n(n1)c(=O)/c(=C/c1cn(nc1c1cccs1)c1ccccc1)/s2

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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 C26H17N5O3S2 MW 511.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H17N5O3S2/c1-16(32)34-20-11-6-5-10-19(20)24-27-26-31(29-24)25(33)22(36-26)14-17-15-30(18-8-3-2-4-9-18)28-23(17)21-12-7-13-35-21/h2-15H,1H3/b22-14-
InChIKey
YJMHNOWXDGEYDM-HMAPJEAMSA-N
Synonyms
442552-25-2
(2((5Z)6OXO5((1PHENYL3THIOPHEN2YLPYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL2YL)PHENYL)ACETATE
(Z)2(6oxo5((1phenyl3(thiophen2yl)1Hpyrazol4yl)methylene)56dihydrothiazolo(32b)(124)triazol2yl)phenylacetate
2((5Z)6oxo5((1phenyl3(thiophen2yl)1Hpyrazol4yl)methylidene)56dihydro(13)thiazolo(32b)(124)triazol2yl)phenylacetate
442552252
CC(=O)OC1=CC=CC=C1C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC=CS5)C6=CC=CC=C6)SC3=N2
CC(=O)Oc1ccccc1c1nc2n(n1)c(=O)c(=Cc1cn(nc1c1cccs1)c1ccccc1)s2
InChI=1SC26H17N5O3S2c116(32)342011651019(20)24272631(2924)25(33)22(3626)14171530(188324918)2823(17)21127133521h215H1H3b2214
MFCD03017198
ZINC000001762206
ZINC01762206
ZINC1762206

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Available files

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