Vitas-M small molecule compound
4-{5-ethyl-2-[5-(4-fluorophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}phenyl benzoate
Catalog ID
STK673716
SMILES CCc1sc(nc1c1ccc(cc1)OC(=O)c1ccccc1)N1N=C(CC1c1ccc(cc1)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 C31H24FN3O2S2 MW 553.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H24FN3O2S2/c1-2-27-29(21-12-16-24(17-13-21)37-30(36)22-7-4-3-5-8-22)33-31(39-27)35-26(20-10-14-23(32)15-11-20)19-25(34-35)28-9-6-18-38-28/h3-18,26H,2,19H2,1H3InChIKey
VNOUBFIHZIAATQ-UHFFFAOYSA-NSynonyms
(4(5ETHYL2(3(4FLUOROPHENYL)5THIOPHEN2YL34DIHYDROPYRAZOL2YL)13THIAZOL4YL)PHENYL)BENZOATE
4(5ethyl2(5(4fluorophenyl)3(thiophen2yl)45dihydro1Hpyrazol1yl)13thiazol4yl)phenylbenzoate
CCC1=C(N=C(S1)N2C(CC(=N2)C3=CC=CS3)C4=CC=C(C=C4)F)C5=CC=C(C=C5)OC(=O)C6=CC=CC=C6
InChI=1SC31H24FN3O2S2c122729(21121624(171321)3730(36)227435822)3331(3927)3526(20101423(32)151120)1925(3435)2896183828h31826H219H21H3
MFCD01239875
ZINC000008407301
ZINC000008407305
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