Vitas-M small molecule compound

methyl 4-{[(2Z,5Z)-3-butyl-5-(3-ethyl-5-methoxy-1,3-benzothiazol-2(3H)-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoate

Catalog ID
STK384480
SMILES CCCCN1/C(=N/c2ccc(cc2)C(=O)OC)/S/C(=c/2\sc3c(n2CC)cc(cc3)OC)/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 C25H27N3O4S2 MW 497.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O4S2/c1-5-7-14-28-22(29)21(23-27(6-2)19-15-18(31-3)12-13-20(19)33-23)34-25(28)26-17-10-8-16(9-11-17)24(30)32-4/h8-13,15H,5-7,14H2,1-4H3/b23-21-,26-25-
InChIKey
XIJVEUOMJIGAOP-NVHKDRNZSA-N
Synonyms

CCCCN1C(=Nc2ccc(cc2)C(=O)OC)SC(=c2sc3c(n2CC)cc(cc3)OC)C1=O
methyl4(((2Z5Z)3butyl5(3ethyl5methoxy13benzothiazol2(3H)ylidene)4oxo13thiazolidin2ylidene)amino)benzoate
MFCD04042003
ZINC000028615434

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Available files

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