Vitas-M small molecule compound
4-{(Z)-[3-(3-methoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenyl 4-chlorobenzoate
Catalog ID
STK809626
SMILES COCCCN1C(=S)S/C(=C\c2ccc(cc2)OC(=O)c2ccc(cc2)Cl)/C1=O
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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 C21H18ClNO4S2 MW 447.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClNO4S2/c1-26-12-2-11-23-19(24)18(29-21(23)28)13-14-3-9-17(10-4-14)27-20(25)15-5-7-16(22)8-6-15/h3-10,13H,2,11-12H2,1H3/b18-13-InChIKey
LDHMYVDIDKPBEC-AQTBWJFISA-NSynonyms
(4((Z)(3(3METHOXYPROPYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)4CHLOROBENZOATE
4((Z)(3(3methoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)phenyl4chlorobenzoate
COCCCN1C(=O)C(=CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)Cl)SC1=S
COCCCN1C(=S)SC(=Cc2ccc(cc2)OC(=O)c2ccc(cc2)Cl)C1=O
InChI=1SC21H18ClNO4S2c126122112319(24)18(2921(23)28)13143917(10414)2720(25)155716(22)8615h31013H21112H21H3b1813
MFCD03461428
ZINC000002682714
ZINC02682714
ZINC2682714
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