Vitas-M small molecule compound
ethyl 1-(3-bromophenyl)-5-{[(3-chloro-1-benzothiophen-2-yl)carbonyl]amino}-1H-pyrazole-4-carboxylate
Catalog ID
STK317452
SMILES CCOC(=O)c1cnn(c1NC(=O)c1sc2c(c1Cl)cccc2)c1cccc(c1)Br
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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 C21H15BrClN3O3S MW 504.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15BrClN3O3S/c1-2-29-21(28)15-11-24-26(13-7-5-6-12(22)10-13)19(15)25-20(27)18-17(23)14-8-3-4-9-16(14)30-18/h3-11H,2H2,1H3,(H,25,27)InChIKey
QZLKACGHERGHDW-UHFFFAOYSA-NSynonyms
492427-47-1492427471
CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)Br)NC(=O)C3=C(C4=CC=CC=C4S3)Cl
ethyl1(3bromophenyl)5(((3chloro1benzothiophen2yl)carbonyl)amino)1Hpyrazole4carboxylate
ETHYL1(3BROMOPHENYL)5((3CHLORO1BENZOTHIOPHENE2CARBONYL)AMINO)PYRAZOLE4CARBOXYLATE
InChI=1SC21H15BrClN3O3Sc122921(28)15112426(1375612(22)1013)19(15)2520(27)1817(23)14834916(14)3018h311H2H21H3(H2527)
MFCD02243173
ZINC000002768872
ZINC02768872
ZINC2768872
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