Vitas-M small molecule compound
3-[(5Z)-4-oxo-2-thioxo-5-{4-[2,2,2-trichloro-1-(propanoylamino)ethoxy]benzylidene}-1,3-thiazolidin-3-yl]propanoic acid
Catalog ID
STK861513
SMILES CCC(=O)NC(C(Cl)(Cl)Cl)Oc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCC(=O)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 C18H17Cl3N2O5S2 MW 511.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17Cl3N2O5S2/c1-2-13(24)22-16(18(19,20)21)28-11-5-3-10(4-6-11)9-12-15(27)23(17(29)30-12)8-7-14(25)26/h3-6,9,16H,2,7-8H2,1H3,(H,22,24)(H,25,26)/b12-9-InChIKey
FBKCZIRZUACWRV-XFXZXTDPSA-NSynonyms
3((5Z)4oxo2sulfanylidene5((4(222trichloro1(propanoylamino)ethoxy)phenyl)methylidene)13thiazolidin3yl)propanoicacid
3((5Z)4oxo2thioxo5(4(222trichloro1(propanoylamino)ethoxy)benzylidene)13thiazolidin3yl)propanoicacid
CCC(=O)NC(C(Cl)(Cl)Cl)OC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)O
CCC(=O)NC(C(Cl)(Cl)Cl)Oc1ccc(cc1)C=C1SC(=S)N(C1=O)CCC(=O)O
InChI=1SC18H17Cl3N2O5S2c1213(24)2216(18(1920)21)28115310(4611)91215(27)23(17(29)3012)8714(25)26h36916H278H21H3(H2224)(H2526)b129
MFCD01458419
ZINC000026967132
ZINC000026967141
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