Vitas-M small molecule compound
4-{[(2E,5Z)-5-(3-chloro-4,5-dimethoxybenzylidene)-4-oxo-1,3-thiazolidin-2-ylidene]amino}phenyl propanoate
Catalog ID
STL172435
SMILES CCC(=O)Oc1ccc(cc1)/N=C\1/S/C(=C\c2cc(Cl)c(c(c2)OC)OC)/C(=O)N1
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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 C21H19ClN2O5S MW 446.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN2O5S/c1-4-18(25)29-14-7-5-13(6-8-14)23-21-24-20(26)17(30-21)11-12-9-15(22)19(28-3)16(10-12)27-2/h5-11H,4H2,1-3H3,(H,23,24,26)/b17-11-InChIKey
WBCFRPXGZRVMMB-BOPFTXTBSA-NSynonyms
(4(((5Z)5((3chloro45dimethoxyphenyl)methylidene)4oxo13thiazol2yl)amino)phenyl)propanoate
4(((2E5Z)5(3chloro45dimethoxybenzylidene)4oxo13thiazolidin2ylidene)amino)phenylpropanoate
CCC(=O)OC1=CC=C(C=C1)NC2=NC(=O)C(=CC3=CC(=C(C(=C3)Cl)OC)OC)S2
CCC(=O)Oc1ccc(cc1)N=C1SC(=Cc2cc(Cl)c(c(c2)OC)OC)C(=O)N1
InChI=1SC21H19ClN2O5Sc1418(25)29147513(6814)23212420(26)17(3021)1112915(22)19(283)16(1012)272h511H4H213H3(H232426)b1711
MFCD04047551
ZINC000002773614
ZINC02773614
ZINC2773614
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