Vitas-M small molecule compound
N~2~-{[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]acetyl}-N-(4-methoxyphenyl)-2-methyl-N~2~-[4-(trifluoromethyl)benzyl]alaninamide
Catalog ID
STL439360
SMILES COc1ccc(cc1)NC(=O)C(N(C(=O)CC1C(C1(C)C)c1c(C)[nH]c2c1cccc2)Cc1ccc(cc1)C(F)(F)F)(C)C
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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 C35H38F3N3O3 MW 605.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H38F3N3O3/c1-21-30(26-9-7-8-10-28(26)39-21)31-27(33(31,2)3)19-29(42)41(20-22-11-13-23(14-12-22)35(36,37)38)34(4,5)32(43)40-24-15-17-25(44-6)18-16-24/h7-18,27,31,39H,19-20H2,1-6H3,(H,40,43)InChIKey
BSMRTUNOTMMWPL-UHFFFAOYSA-NSynonyms
2((2(22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)ACETYL)((4(TRIFLUOROMETHYL)PHENYL)METHYL)AMINO)N(4METHOXYPHENYL)2METHYLPROPANAMIDE
2(2((1R3S)22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)N(4(TRIFLUOROMETHYL)BENZYL)ACETAMIDO)N(4METHOXYPHENYL)2METHYLPROPANAMIDE
CC1=C(C2=CC=CC=C2N1)C3C(C3(C)C)CC(=O)N(CC4=CC=C(C=C4)C(F)(F)F)C(C)(C)C(=O)NC5=CC=C(C=C5)OC
COc1ccc(cc1)NC(=O)C(N(C(=O)CC1C(C1(C)C)c1c(C)(nH)c2c1cccc2)Cc1ccc(cc1)C(F)(F)F)(C)C
InChI=1SC35H38F3N3O3c12130(269781028(26)3921)3127(33(312)3)1929(42)41(2022111323(141222)35(3637)38)34(45)32(43)4024151725(446)181624h718273139H1920H216H3(H4043)
MFCD29709758
N~2~((22dimethyl3(2methyl1Hindol3yl)cyclopropyl)acetyl)N(4methoxyphenyl)2methylN~2~(4(trifluoromethyl)benzyl)alaninamide
ZINC000008749043
ZINC000101386423
Check stock
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Check stock on Vitas-MAvailable files
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