Vitas-M small molecule compound

(3s,5s,7s)-N-[(5E)-5-(anthracen-9-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide

Catalog ID
STK113409
SMILES S=C1S/C(=C/c2c3ccccc3cc3c2cccc3)/C(=O)N1NC(=O)C12C[C@@H]3C[C@H](C2)C[C@H](C1)C3

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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 C29H26N2O2S2 MW 498.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N2O2S2/c32-26-25(13-24-22-7-3-1-5-20(22)12-21-6-2-4-8-23(21)24)35-28(34)31(26)30-27(33)29-14-17-9-18(15-29)11-19(10-17)16-29/h1-8,12-13,17-19H,9-11,14-16H2,(H,30,33)/b25-13+/t17-,18+,19-,29?
InChIKey
FNCGHJVOFPGSJZ-WVSZNMLTSA-N
Synonyms

(3s5s7s)N((5E)5(anthracen9ylmethylidene)4oxo2thioxo13thiazolidin3yl)tricyclo(3311~37~)decane1carboxamide
MFCD04087348
S=C1SC(=Cc2c3ccccc3cc3c2cccc3)C(=O)N1NC(=O)C12C(C@@H)3C(C@H)(C2)C(C@H)(C1)C3
ZINC000009233704

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Available files

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