Vitas-M small molecule compound
methyl 2-chloro-5-{5-[(E)-{3-[2-(morpholin-4-yl)-2-oxoethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl]furan-2-yl}benzoate
Catalog ID
STL379221
SMILES COC(=O)c1cc(ccc1Cl)c1ccc(o1)/C=C\1/SC(=O)N(C1=O)CC(=O)N1CCOCC1
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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 C22H19ClN2O7S MW 490.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN2O7S/c1-30-21(28)15-10-13(2-4-16(15)23)17-5-3-14(32-17)11-18-20(27)25(22(29)33-18)12-19(26)24-6-8-31-9-7-24/h2-5,10-11H,6-9,12H2,1H3/b18-11+InChIKey
CCSYPAHTGYJIBS-WOJGMQOQSA-NSynonyms
COC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)C=C3C(=O)N(C(=O)S3)CC(=O)N4CCOCC4)Cl
COC(=O)c1cc(ccc1Cl)c1ccc(o1)C=C1SC(=O)N(C1=O)CC(=O)N1CCOCC1
InChI=1SC22H19ClN2O7Sc13021(28)151013(2416(15)23)175314(3217)111820(27)25(22(29)3318)1219(26)2468319724h251011H6912H21H3b1811+
methyl2chloro5(5((E)(3(2(morpholin4yl)2oxoethyl)24dioxo13thiazolidin5ylidene)methyl)furan2yl)benzoate
METHYL2CHLORO5(5((E)(3(2MORPHOLIN4YL2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)FURAN2YL)BENZOATE
MFCD05811465
ZINC000001105611
ZINC01105611
ZINC1105611
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