Vitas-M small molecule compound

3-({3-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}amino)benzoic acid

Catalog ID
STK535021
SMILES O=C(Nc1cccc(c1)C(=O)O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.

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 C21H18N2O4S2 MW 426.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O4S2/c1-13-5-7-14(8-6-13)11-17-19(25)23(21(28)29-17)10-9-18(24)22-16-4-2-3-15(12-16)20(26)27/h2-8,11-12H,9-10H2,1H3,(H,22,24)(H,26,27)/b17-11-
InChIKey
WJWBVNIJPMKGJW-BOPFTXTBSA-N
Synonyms
6615-95-8
(Z)3(3(5(4methylbenzylidene)4oxo2thioxothiazolidin3yl)propanamido)benzoicacid
3((3((5Z)5(4methylbenzylidene)4oxo2thioxo13thiazolidin3yl)propanoyl)amino)benzoicacid
3(3((5Z)4OXO5(PTOLYLMETHYLENE)2THIOXOTHIAZOLIDIN3YL)PROPANOYLAMINO)BENZOICACID
3(3((5Z)5((4METHYLPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOYLAMINO)BENZOICACID
3(3(4OXO2THIOXO5(1PTOLYLMETH(Z)YLIDENE)THIAZOLIDIN3YL)PROPIONYLAMINO)BENZOICACID
6615958
BENZOICACID3((3((5Z)5((4METHYLPHENYL)METHYLENE)4OXO2THIOXO3THIAZOLIDINYL)1OXOPROPYL)AMINO)
CC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)NC3=CC=CC(=C3)C(=O)O
InChI=1SC21H18N2O4S2c1135714(8613)111719(25)23(21(28)2917)10918(24)221642315(1216)20(26)27h281112H910H21H3(H2224)(H2627)b1711
MFCD02369763
O=C(Nc1cccc(c1)C(=O)O)CCN1C(=S)SC(=Cc2ccc(cc2)C)C1=O
ZINC000013606953
ZINC13606953

Check stock

See real-time availability and sample size for STK535021 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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