Vitas-M small molecule compound
methyl [(5E)-5-{[1-(3-chloro-4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate
Catalog ID
STK152313
SMILES COC(=O)CN1C(=O)S/C(=C/c2cc(n(c2C)c2ccc(c(c2)Cl)F)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 C19H16ClFN2O4S MW 422.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClFN2O4S/c1-10-6-12(11(2)23(10)13-4-5-15(21)14(20)8-13)7-16-18(25)22(19(26)28-16)9-17(24)27-3/h4-8H,9H2,1-3H3/b16-7+InChIKey
YZVYFPJQMTVGLS-FRKPEAEDSA-NSynonyms
CC1=CC(=C(N1C2=CC(=C(C=C2)F)Cl)C)C=C3C(=O)N(C(=O)S3)CC(=O)OC
COC(=O)CN1C(=O)SC(=Cc2cc(n(c2C)c2ccc(c(c2)Cl)F)C)C1=O
InChI=1SC19H16ClFN2O4Sc110612(11(2)23(10)134515(21)14(20)813)71618(25)22(19(26)2816)917(24)273h48H9H213H3b167+
METHYL((5E)5((1(3CHLORO4FLUOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
METHYL2((5E)5((1(3CHLORO4FLUOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
MFCD03993115
ZINC000002817724
ZINC02817724
ZINC2817724
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