Vitas-M small molecule compound
4-{(Z)-[3-(furan-2-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenyl 4-nitrobenzoate
Catalog ID
STK701593
SMILES COc1cc(ccc1OC(=O)c1ccc(cc1)[N+](=O)[O-])/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 C23H16N2O7S2 MW 496.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16N2O7S2/c1-30-19-11-14(12-20-21(26)24(23(33)34-20)13-17-3-2-10-31-17)4-9-18(19)32-22(27)15-5-7-16(8-6-15)25(28)29/h2-12H,13H2,1H3/b20-12-InChIKey
UWKPXBDJELUXAB-NDENLUEZSA-NSynonyms
(4((Z)(3(FURAN2YLMETHYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)2METHOXYPHENYL)4NITROBENZOATE
(E)4((3(furan2ylmethyl)4oxo2thioxothiazolidin5ylidene)methyl)2methoxyphenyl4nitrobenzoate
4((Z)(3(furan2ylmethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2methoxyphenyl4nitrobenzoate
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC3=CC=CO3)OC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
COc1cc(ccc1OC(=O)c1ccc(cc1)(N+)(=O)(O))C=C1SC(=S)N(C1=O)Cc1ccco1
InChI=1SC23H16N2O7S2c130191114(122021(26)24(23(33)3420)131732103117)4918(19)3222(27)155716(8615)25(28)29h212H13H21H3b2012
MFCD03461542
ZINC000026686963
ZINC26686963
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