Vitas-M small molecule compound
[(5E)-5-{[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STL428296
SMILES OC(=O)CN1C(=S)S/C(=C/c2cc(n(c2C)c2ccc(cc2)Br)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 C18H15BrN2O3S2 MW 451.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15BrN2O3S2/c1-10-7-12(11(2)21(10)14-5-3-13(19)4-6-14)8-15-17(24)20(9-16(22)23)18(25)26-15/h3-8H,9H2,1-2H3,(H,22,23)/b15-8+InChIKey
DUXWOUSSUPYMHS-OVCLIPMQSA-NSynonyms
((5E)5((1(4bromophenyl)25dimethyl1Hpyrrol3yl)methylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
2((5E)5((1(4BROMOPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
2(5((1(4BROMOPHENYL)25DIMETHYLPYRROL3YL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)C=C3C(=O)N(C(=S)S3)CC(=O)O
InChI=1SC18H15BrN2O3S2c110712(11(2)21(10)145313(19)4614)81517(24)20(916(22)23)18(25)2615h38H9H212H3(H2223)b158+
MFCD02316611
OC(=O)CN1C(=S)SC(=Cc2cc(n(c2C)c2ccc(cc2)Br)C)C1=O
ZINC000009311748
ZINC9311748
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