Vitas-M small molecule compound
{(2E)-2-[(2E)-{[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}hydrazinylidene]-4-oxo-1,3-thiazolidin-5-yl}acetic acid
Catalog ID
STL383722
SMILES OC(=O)CC1S/C(=N/N=C/c2cc(n(c2C)c2ccc(cc2)Br)C)/NC1=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 C18H17BrN4O3S MW 449.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17BrN4O3S/c1-10-7-12(11(2)23(10)14-5-3-13(19)4-6-14)9-20-22-18-21-17(26)15(27-18)8-16(24)25/h3-7,9,15H,8H2,1-2H3,(H,24,25)(H,21,22,26)/b20-9+InChIKey
NKCLVLBBZOEKPB-AWQFTUOYSA-NSynonyms
((2E)2((2E)((1(4bromophenyl)25dimethyl1Hpyrrol3yl)methylidene)hydrazinylidene)4oxo13thiazolidin5yl)aceticacid
2(2((2E)2((1(4bromophenyl)25dimethylpyrrol3yl)methylidene)hydrazinyl)4oxo13thiazol5yl)aceticacid
CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)C=NNC3=NC(=O)C(S3)CC(=O)O
InChI=1SC18H17BrN4O3Sc110712(11(2)23(10)145313(19)4614)92022182117(26)15(2718)816(24)25h37915H8H212H3(H2425)(H212226)b209+
MFCD03217427
OC(=O)CC1SC(=NN=Cc2cc(n(c2C)c2ccc(cc2)Br)C)NC1=O
ZINC000033498996
ZINC000033499000
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