Vitas-M small molecule compound

2-methoxy-4-[(E)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl tricyclo[3.3.1.1~3,7~]decane-1-carboxylate

Catalog ID
STL427704
SMILES COc1cc(ccc1OC(=O)C12CC3CC(C2)CC(C1)C3)/C=C\1/SC(=S)N(C1=O)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 C23H25NO4S2 MW 443.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO4S2/c1-24-20(25)19(30-22(24)29)9-13-3-4-17(18(8-13)27-2)28-21(26)23-10-14-5-15(11-23)7-16(6-14)12-23/h3-4,8-9,14-16H,5-7,10-12H2,1-2H3/b19-9+
InChIKey
AIEMODGXUZLCOA-DJKKODMXSA-N
Synonyms

(2METHOXY4((E)(3METHYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)ADAMANTANE1CARBOXYLATE
2METHOXY4((3METHYL4OXO2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)PHENYLADAMANTANECARBOXYLATE
2methoxy4((E)(3methyl4oxo2thioxo13thiazolidin5ylidene)methyl)phenyltricyclo(3311~37~)decane1carboxylate
CN1C(=O)C(=CC2=CC(=C(C=C2)OC(=O)C34CC5CC(C3)CC(C5)C4)OC)SC1=S
COc1cc(ccc1OC(=O)C12CC3CC(C2)CC(C1)C3)C=C1SC(=S)N(C1=O)C
InChI=1SC23H25NO4S2c12420(25)19(3022(24)29)9133417(18(813)272)2821(26)231014515(1123)716(614)1223h34891416H571012H212H3b199+
ZINC000009310277
ZINC09310277
ZINC9310277

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Available files

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