Vitas-M small molecule compound

2-[(5Z)-5-(4-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[2-(4-hydroxyphenyl)ethyl]propanamide

Catalog ID
STK614754
SMILES Oc1ccc(cc1)CCNC(=O)C(N1C(=S)S/C(=C\c2ccc(cc2)Cl)/C1=O)C

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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 C21H19ClN2O3S2 MW 446.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN2O3S2/c1-13(19(26)23-11-10-14-4-8-17(25)9-5-14)24-20(27)18(29-21(24)28)12-15-2-6-16(22)7-3-15/h2-9,12-13,25H,10-11H2,1H3,(H,23,26)/b18-12-
InChIKey
WSJOZDVTHRADJK-PDGQHHTCSA-N
Synonyms

(Z)2(5(4chlorobenzylidene)4oxo2thioxothiazolidin3yl)N(4hydroxyphenethyl)propanamide
2((5Z)5((4CHLOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)N(2(4HYDROXYPHENYL)ETHYL)PROPANAMIDE
2((5Z)5(4chlorobenzylidene)4oxo2thioxo13thiazolidin3yl)N(2(4hydroxyphenyl)ethyl)propanamide
2(5((4CHLOROPHENYL)METHYLENE)4OXO2THIOXO(13THIAZOLIDIN3YL))N(2(4HYDROXYPHENYL)ETHYL)PROPANAMIDE
CC(C(=O)NCCC1=CC=C(C=C1)O)N2C(=O)C(=CC3=CC=C(C=C3)Cl)SC2=S
InChI=1SC21H19ClN2O3S2c113(19(26)231110144817(25)9514)2420(27)18(2921(24)28)12152616(22)7315h29121325H1011H21H3(H2326)b1812
MFCD06783901
Oc1ccc(cc1)CCNC(=O)C(N1C(=S)SC(=Cc2ccc(cc2)Cl)C1=O)C
ZINC000009215823
ZINC000013572013

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.