Vitas-M small molecule compound

ethyl (5Z)-2-[(4-chlorophenyl)amino]-5-(3-nitrobenzylidene)-4-oxo-4,5-dihydrothiophene-3-carboxylate

Catalog ID
STK083961
SMILES CCOC(=O)C1=C(Nc2ccc(cc2)Cl)S/C(=C\c2cccc(c2)[N+](=O)[O-])/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 C20H15ClN2O5S MW 430.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClN2O5S/c1-2-28-20(25)17-18(24)16(11-12-4-3-5-15(10-12)23(26)27)29-19(17)22-14-8-6-13(21)7-9-14/h3-11,22H,2H2,1H3/b16-11-
InChIKey
OVSAHXHJZHKWBY-WJDWOHSUSA-N
Synonyms

CCOC(=O)C1=C(Nc2ccc(cc2)Cl)SC(=Cc2cccc(c2)(N+)(=O)(O))C1=O
CCOC(=O)C1=C(SC(=CC2=CC(=CC=C2)(N+)(=O)(O))C1=O)NC3=CC=C(C=C3)Cl
ETHYL(5Z)2((4CHLOROPHENYL)AMINO)5(3NITROBENZYLIDENE)4OXO45DIHYDROTHIOPHENE3CARBOXYLATE
ETHYL(5Z)2(4CHLOROANILINO)5((3NITROPHENYL)METHYLIDENE)4OXOTHIOPHENE3CARBOXYLATE
InChI=1SC20H15ClN2O5Sc122820(25)1718(24)16(111243515(1012)23(26)27)2919(17)22148613(21)7914h31122H2H21H3b1611
MFCD08679707
STK083961
ZINC000009678979
ZINC09678979
ZINC9678979

Check stock

See real-time availability and sample size for STK083961 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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