Vitas-M small molecule compound

ethyl 2-({[3-chloro-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK342706
SMILES CCOC(=O)c1c(sc2c1CCCC2)NC(=O)c1nn2c(c1Cl)nc(cc2C(F)(F)F)c1cccs1

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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 C23H18ClF3N4O3S2 MW 555.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClF3N4O3S2/c1-2-34-22(33)16-11-6-3-4-7-13(11)36-21(16)29-20(32)18-17(24)19-28-12(14-8-5-9-35-14)10-15(23(25,26)27)31(19)30-18/h5,8-10H,2-4,6-7H2,1H3,(H,29,32)
InChIKey
GAYLREQPEBEUKS-UHFFFAOYSA-N
Synonyms
313247-58-4
313247584
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=NN4C(=CC(=NC4=C3Cl)C5=CC=CS5)C(F)(F)F
ethyl2(((3chloro5(thiophen2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((3chloro5thiophen2yl7(trifluoromethyl)pyrazolo(15a)pyrimidine2carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2(3chloro5(thiophen2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidine2carboxamido)4567tetrahydrobenzo(b)thiophene3carboxylate
InChI=1SC23H18ClF3N4O3S2c123422(33)1611634713(11)3621(16)2920(32)1817(24)192812(148593514)1015(23(2526)27)31(19)3018h5810H2467H21H3(H2932)
MFCD01010138
ZINC000001896712
ZINC01896712
ZINC1896712

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Available files

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