Vitas-M small molecule compound

3-[(5Z)-5-(3-bromobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(4-methoxyphenyl)propanamide

Catalog ID
STK994470
SMILES COc1ccc(cc1)NC(=O)CCN1C(=S)S/C(=C\c2cccc(c2)Br)/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 C20H17BrN2O3S2 MW 477.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17BrN2O3S2/c1-26-16-7-5-15(6-8-16)22-18(24)9-10-23-19(25)17(28-20(23)27)12-13-3-2-4-14(21)11-13/h2-8,11-12H,9-10H2,1H3,(H,22,24)/b17-12-
InChIKey
LNYZAVBNNCEFGB-ATVHPVEESA-N
Synonyms

3((5Z)5((3BROMOPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)N(4METHOXYPHENYL)PROPANAMIDE
3((5Z)5(3bromobenzylidene)4oxo2thioxo13thiazolidin3yl)N(4methoxyphenyl)propanamide
3(5((3BROMOPHENYL)METHYLENE)4OXO2THIOXO(13THIAZOLIDIN3YL))N(4METHOXYPHENYL)PROPANAMIDE
COC1=CC=C(C=C1)NC(=O)CCN2C(=O)C(=CC3=CC(=CC=C3)Br)SC2=S
COc1ccc(cc1)NC(=O)CCN1C(=S)SC(=Cc2cccc(c2)Br)C1=O
InChI=1SC20H17BrN2O3S2c126167515(6816)2218(24)9102319(25)17(2820(23)27)121332414(21)1113h281112H910H21H3(H2224)b1712
MFCD02364894
ZINC000001239493
ZINC01239493
ZINC1239493

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Available files

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