Vitas-M small molecule compound

2-methoxy-4-{(E)-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenyl 2-methylbenzoate

Catalog ID
STK701630
SMILES COc1cc(ccc1OC(=O)c1ccccc1C)/C=C\1/SC(=S)N(C1=O)CC1CCCO1

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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 C24H23NO5S2 MW 469.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23NO5S2/c1-15-6-3-4-8-18(15)23(27)30-19-10-9-16(12-20(19)28-2)13-21-22(26)25(24(31)32-21)14-17-7-5-11-29-17/h3-4,6,8-10,12-13,17H,5,7,11,14H2,1-2H3/b21-13+
InChIKey
YODWBDLMICYCLV-FYJGNVAPSA-N
Synonyms

(2methoxy4((E)(4oxo3(oxolan2ylmethyl)2sulfanylidene13thiazolidin5ylidene)methyl)phenyl)2methylbenzoate
(Z)2methoxy4((4oxo3((tetrahydrofuran2yl)methyl)2thioxothiazolidin5ylidene)methyl)phenyl2methylbenzoate
2methoxy4((E)(4oxo3(tetrahydrofuran2ylmethyl)2thioxo13thiazolidin5ylidene)methyl)phenyl2methylbenzoate
CC1=CC=CC=C1C(=O)OC2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)CC4CCCO4)OC
COc1cc(ccc1OC(=O)c1ccccc1C)C=C1SC(=S)N(C1=O)CC1CCCO1
InChI=1SC24H23NO5S2c115634818(15)23(27)301910916(1220(19)282)132122(26)25(24(31)3221)141775112917h346810121317H571114H212H3b2113+
MFCD03461562
ZINC000026687006
ZINC000026687011

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Available files

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