Vitas-M small molecule compound
N-{3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-5-(5-ethylthiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Catalog ID
STK449597
SMILES CCc1ccc(s1)c1nc2cc(nn2c(c1)C(F)(F)F)C(=O)Nc1sc2c(c1C(=O)Nc1ccc(cc1)Cl)CCCC2
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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 C29H23ClF3N5O2S2 MW 630.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23ClF3N5O2S2/c1-2-17-11-12-22(41-17)19-13-23(29(31,32)33)38-24(35-19)14-20(37-38)26(39)36-28-25(18-5-3-4-6-21(18)42-28)27(40)34-16-9-7-15(30)8-10-16/h7-14H,2-6H2,1H3,(H,34,40)(H,36,39)InChIKey
HXGWNKSQWKMXHC-UHFFFAOYSA-NSynonyms
CCC1=CC=C(S1)C2=NC3=CC(=NN3C(=C2)C(F)(F)F)C(=O)NC4=C(C5=C(S4)CCCC5)C(=O)NC6=CC=C(C=C6)Cl
InChI=1SC29H23ClF3N5O2S2c1217111222(4117)191323(29(3132)33)3824(3519)1420(3738)26(39)362825(18534621(18)4228)27(40)34169715(30)81016h714H26H21H3(H3440)(H3639)
MFCD03468221
N(3((4chlorophenyl)carbamoyl)4567tetrahydro1benzothiophen2yl)5(5ethylthiophen2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidine2carboxamide
ZINC000008455312
ZINC08455312
ZINC8455312
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