Vitas-M small molecule compound
{2-chloro-4-[(E)-{(2Z)-2-[(4-ethylphenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl]phenoxy}acetic acid
Catalog ID
STK159727
SMILES CCc1ccc(cc1)/N=C\1/NC(=O)/C(=C\c2ccc(c(c2)Cl)OCC(=O)O)/S1
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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 C20H17ClN2O4S MW 416.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN2O4S/c1-2-12-3-6-14(7-4-12)22-20-23-19(26)17(28-20)10-13-5-8-16(15(21)9-13)27-11-18(24)25/h3-10H,2,11H2,1H3,(H,24,25)(H,22,23,26)/b17-10+InChIKey
ABNIYDTWWMFBAN-LICLKQGHSA-NSynonyms
(2CHLORO4((E)((2Z)2((4ETHYLPHENYL)IMINO)4OXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)ACETICACID
2(2chloro4((E)((Z)2((4ethylphenyl)imino)4oxothiazolidin5ylidene)methyl)phenoxy)aceticacid
2(2CHLORO4((E)(2(4ETHYLANILINO)4OXO13THIAZOL5YLIDENE)METHYL)PHENOXY)ACETICACID
CCC1=CC=C(C=C1)NC2=NC(=O)C(=CC3=CC(=C(C=C3)OCC(=O)O)Cl)S2
CCc1ccc(cc1)N=C1NC(=O)C(=Cc2ccc(c(c2)Cl)OCC(=O)O)S1
InChI=1SC20H17ClN2O4Sc12123614(7412)22202319(26)17(2820)10135816(15(21)913)271118(24)25h310H211H21H3(H2425)(H222326)b1710+
MFCD02904902
ZINC000004696386
ZINC4696386
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