Vitas-M small molecule compound

2-methylpropyl (2Z,3E)-2-[4-(3,4-dichlorophenyl)-2-phenyl-3-thioxo-1,2,4-thiadiazolidin-5-ylidene]-3-(propylimino)butanoate

Catalog ID
STL338807
SMILES CCC/N=C(/C(=c\1/sn(c(=S)n1c1ccc(c(c1)Cl)Cl)c1ccccc1)/C(=O)OCC(C)C)\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 C25H27Cl2N3O2S2 MW 536.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27Cl2N3O2S2/c1-5-13-28-17(4)22(24(31)32-15-16(2)3)23-29(19-11-12-20(26)21(27)14-19)25(33)30(34-23)18-9-7-6-8-10-18/h6-12,14,16H,5,13,15H2,1-4H3/b23-22-,28-17+
InChIKey
MNTXCHPUBBXVEQ-OAZWPOJRSA-N
Synonyms
840478-55-9
(2Z3E)isobutyl2(4(34dichlorophenyl)2phenyl3thioxo124thiadiazolidin5ylidene)3(propylimino)butanoate
2methylpropyl(2Z3E)2(4(34dichlorophenyl)2phenyl3thioxo124thiadiazolidin5ylidene)3(propylimino)butanoate
840478559
CCCN=C(C(=c1sn(c(=S)n1c1ccc(c(c1)Cl)Cl)c1ccccc1)C(=O)OCC(C)C)C
MFCD04006372
ZINC000101030968

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Available files

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