Vitas-M small molecule compound

N-(3-bromophenyl)-2-[(1-{3-[(5Z)-5-(4-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}-1H-benzimidazol-2-yl)sulfanyl]acetamide

Catalog ID
STK702942
SMILES O=C(Nc1cccc(c1)Br)CSc1nc2c(n1C(=O)CCN1C(=S)S/C(=C\c3ccc(cc3)Cl)/C1=O)cccc2

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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 C28H20BrClN4O3S3 MW 672.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20BrClN4O3S3/c29-18-4-3-5-20(15-18)31-24(35)16-39-27-32-21-6-1-2-7-22(21)34(27)25(36)12-13-33-26(37)23(40-28(33)38)14-17-8-10-19(30)11-9-17/h1-11,14-15H,12-13,16H2,(H,31,35)/b23-14-
InChIKey
XLHJTOUUAANPIG-UCQKPKSFSA-N
Synonyms

(Z)N(3bromophenyl)2((1(3(5(4chlorobenzylidene)4oxo2thioxothiazolidin3yl)propanoyl)1Hbenzo(d)imidazol2yl)thio)acetamide
C1=CC=C2C(=C1)N=C(N2C(=O)CCN3C(=O)C(=CC4=CC=C(C=C4)Cl)SC3=S)SCC(=O)NC5=CC(=CC=C5)Br
InChI=1SC28H20BrClN4O3S3c291843520(1518)3124(35)1639273221612722(21)34(27)25(36)12133326(37)23(4028(33)38)141781019(30)11917h1111415H121316H2(H3135)b2314
MFCD02995431
N(3bromophenyl)2((1(3((5Z)5(4chlorobenzylidene)4oxo2thioxo13thiazolidin3yl)propanoyl)1Hbenzimidazol2yl)sulfanyl)acetamide
N(3BROMOPHENYL)2(1(3((5Z)5((4CHLOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOYL)BENZIMIDAZOL2YL)SULFANYLACETAMIDE
O=C(Nc1cccc(c1)Br)CSc1nc2c(n1C(=O)CCN1C(=S)SC(=Cc3ccc(cc3)Cl)C1=O)cccc2
ZINC000097946377
ZINC97946377

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Available files

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