Vitas-M small molecule compound
propan-2-yl 2-({[5-(5-ethylthiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK449598
SMILES CCc1ccc(s1)c1nc2cc(nn2c(c1)C(F)(F)F)C(=O)Nc1sc2c(c1C(=O)OC(C)C)CCC(C2)c1ccccc1
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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 C32H29F3N4O3S2 MW 638.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29F3N4O3S2/c1-4-20-11-13-24(43-20)22-15-26(32(33,34)35)39-27(36-22)16-23(38-39)29(40)37-30-28(31(41)42-17(2)3)21-12-10-19(14-25(21)44-30)18-8-6-5-7-9-18/h5-9,11,13,15-17,19H,4,10,12,14H2,1-3H3,(H,37,40)InChIKey
CRZMZSBZJNCNAR-UHFFFAOYSA-NSynonyms
CCC1=CC=C(S1)C2=NC3=CC(=NN3C(=C2)C(F)(F)F)C(=O)NC4=C(C5=C(S4)CC(CC5)C6=CC=CC=C6)C(=O)OC(C)C
InChI=1SC32H29F3N4O3S2c1420111324(4320)221526(32(3334)35)3927(3622)1623(3839)29(40)373028(31(41)4217(2)3)21121019(1425(21)4430)188657918h591113151719H4101214H213H3(H3740)
MFCD03467699
propan2yl2(((5(5ethylthiophen2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)carbonyl)amino)6phenyl4567tetrahydro1benzothiophene3carboxylate
propan2yl2((5(5ethylthiophen2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidine2carbonyl)amino)6phenyl4567tetrahydro1benzothiophene3carboxylate
ZINC000008455475
ZINC000008455476
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