Vitas-M small molecule compound
methyl [(5E)-5-{[1-(5-chloro-2-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate
Catalog ID
STK152311
SMILES COC(=O)CN1C(=O)S/C(=C/c2cc(n(c2C)c2cc(Cl)ccc2OC)C)/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 C20H19ClN2O5S MW 434.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN2O5S/c1-11-7-13(8-17-19(25)22(20(26)29-17)10-18(24)28-4)12(2)23(11)15-9-14(21)5-6-16(15)27-3/h5-9H,10H2,1-4H3/b17-8+InChIKey
UZFRSZZDVZMGBK-CAOOACKPSA-NSynonyms
CC1=CC(=C(N1C2=C(C=CC(=C2)Cl)OC)C)C=C3C(=O)N(C(=O)S3)CC(=O)OC
COC(=O)CN1C(=O)SC(=Cc2cc(n(c2C)c2cc(Cl)ccc2OC)C)C1=O
InChI=1SC20H19ClN2O5Sc111713(81719(25)22(20(26)2917)1018(24)284)12(2)23(11)15914(21)5616(15)273h59H10H214H3b178+
METHYL((5E)5((1(5CHLORO2METHOXYPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
METHYL2((5E)5((1(5CHLORO2METHOXYPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
MFCD03700092
ZINC000001018600
ZINC01018600
ZINC1018600
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