Vitas-M small molecule compound
6-tert-butyl-2-{[(2-methylphenoxy)acetyl]amino}-N-[2-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK677245
SMILES O=C(Nc1sc2c(c1C(=O)Nc1ccccc1C(F)(F)F)CCC(C2)C(C)(C)C)COc1ccccc1C
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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 C29H31F3N2O3S MW 544.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31F3N2O3S/c1-17-9-5-8-12-22(17)37-16-24(35)34-27-25(19-14-13-18(28(2,3)4)15-23(19)38-27)26(36)33-21-11-7-6-10-20(21)29(30,31)32/h5-12,18H,13-16H2,1-4H3,(H,33,36)(H,34,35)InChIKey
JEINFAYVCZHEMO-UHFFFAOYSA-NSynonyms
6tertbutyl2(((2methylphenoxy)acetyl)amino)N(2(trifluoromethyl)phenyl)4567tetrahydro1benzothiophene3carboxamide
6tertbutyl2((2(2methylphenoxy)acetyl)amino)N(2(trifluoromethyl)phenyl)4567tetrahydro1benzothiophene3carboxamide
CC1=CC=CC=C1OCC(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C(=O)NC4=CC=CC=C4C(F)(F)F
InChI=1SC29H31F3N2O3Sc1179581222(17)371624(35)342725(19141318(28(23)4)1523(19)3827)26(36)332111761020(21)29(3031)32h51218H1316H214H3(H3336)(H3435)
MFCD02933032
ZINC000002190497
ZINC000002190498
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