Vitas-M small molecule compound
methyl 2-[({5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-yl}carbonyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL384236
SMILES COC(=O)c1c(NC(=O)c2ccc(o2)Cn2nc(c(c2C)Br)C)sc2c1CCC(C2)C
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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 C22H24BrN3O4S MW 506.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24BrN3O4S/c1-11-5-7-15-17(9-11)31-21(18(15)22(28)29-4)24-20(27)16-8-6-14(30-16)10-26-13(3)19(23)12(2)25-26/h6,8,11H,5,7,9-10H2,1-4H3,(H,24,27)InChIKey
HLAJXPBCTXYXCM-UHFFFAOYSA-NSynonyms
489408-83-5489408835
CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC=C(O3)CN4C(=C(C(=N4)C)Br)C
InChI=1SC22H24BrN3O4Sc111571517(911)3121(18(15)22(28)294)2420(27)168614(3016)102613(3)19(23)12(2)2526h6811H57910H214H3(H2427)
methyl2(((5((4bromo35dimethyl1Hpyrazol1yl)methyl)furan2yl)carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
methyl2((5((4bromo35dimethylpyrazol1yl)methyl)furan2carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
MFCD02053749
ZINC000000669140
ZINC000000669143
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