Vitas-M small molecule compound
(5Z)-3-(4-methylbenzyl)-5-{[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK704086
SMILES Cc1ccc(cc1)CN1C(=S)S/C(=C\c2cn(nc2c2cccc(c2)[N+](=O)[O-])c2ccccc2)/C1=O
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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 C27H20N4O3S2 MW 512.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20N4O3S2/c1-18-10-12-19(13-11-18)16-29-26(32)24(36-27(29)35)15-21-17-30(22-7-3-2-4-8-22)28-25(21)20-6-5-9-23(14-20)31(33)34/h2-15,17H,16H2,1H3/b24-15-InChIKey
LIPFKGKLVFGQFX-IWIPYMOSSA-NSynonyms
955876-33-2(5Z)3((4METHYLPHENYL)METHYL)5((3(3NITROPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3(4methylbenzyl)5((3(3nitrophenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(Z)3(4methylbenzyl)5((3(3nitrophenyl)1phenyl1Hpyrazol4yl)methylene)2thioxothiazolidin4one
955876332
CC1=CC=C(C=C1)CN2C(=O)C(=CC3=CN(N=C3C4=CC(=CC=C4)(N+)(=O)(O))C5=CC=CC=C5)SC2=S
Cc1ccc(cc1)CN1C(=S)SC(=Cc2cn(nc2c2cccc(c2)(N+)(=O)(O))c2ccccc2)C1=O
InChI=1SC27H20N4O3S2c118101219(131118)162926(32)24(3627(29)35)15211730(227324822)2825(21)2065923(1420)31(33)34h21517H16H21H3b2415
MFCD03668424
ZINC000002196336
ZINC02196336
ZINC2196336
Check stock
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Check stock on Vitas-MAvailable files
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