Vitas-M small molecule compound
propan-2-yl 2-[({5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-yl}carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK915065
SMILES CC(OC(=O)c1c(NC(=O)c2ccc(o2)Cn2nc(c(c2C)Br)C)sc2c1CCCC2)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 C23H26BrN3O4S MW 520.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26BrN3O4S/c1-12(2)30-23(29)19-16-7-5-6-8-18(16)32-22(19)25-21(28)17-10-9-15(31-17)11-27-14(4)20(24)13(3)26-27/h9-10,12H,5-8,11H2,1-4H3,(H,25,28)InChIKey
VATIKGCMIBIDPC-UHFFFAOYSA-NSynonyms
957484-65-0957484650
CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)OC(C)C)C)Br
InChI=1SC23H26BrN3O4Sc112(2)3023(29)1916756818(16)3222(19)2521(28)1710915(3117)112714(4)20(24)13(3)2627h91012H5811H214H3(H2528)
MFCD01853380
propan2yl2(((5((4bromo35dimethyl1Hpyrazol1yl)methyl)furan2yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
propan2yl2((5((4bromo35dimethylpyrazol1yl)methyl)furan2carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ZINC000000669515
ZINC00669515
ZINC669515
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