Vitas-M small molecule compound

N-[4-(dimethylamino)phenyl]-N~2~-{[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]acetyl}-2-methyl-N~2~-[4-(trifluoromethyl)benzyl]alaninamide

Catalog ID
STL439361
SMILES O=C(N(C(C(=O)Nc1ccc(cc1)N(C)C)(C)C)Cc1ccc(cc1)C(F)(F)F)CC1C(C1(C)C)c1c(C)[nH]c2c1cccc2

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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 C36H41F3N4O2 MW 618.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H41F3N4O2/c1-22-31(27-10-8-9-11-29(27)40-22)32-28(34(32,2)3)20-30(44)43(21-23-12-14-24(15-13-23)36(37,38)39)35(4,5)33(45)41-25-16-18-26(19-17-25)42(6)7/h8-19,28,32,40H,20-21H2,1-7H3,(H,41,45)
InChIKey
ZWUTVIUGFZIZSP-UHFFFAOYSA-N
Synonyms

2(2((1R3S)22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)N(4(TRIFLUOROMETHYL)BENZYL)ACETAMIDO)N(4(DIMETHYLAMINO)PHENYL)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)N(C)C
InChI=1SC36H41F3N4O2c12231(2710891129(27)4022)3228(34(322)3)2030(44)43(2123121424(151323)36(3738)39)35(45)33(45)4125161826(191725)42(6)7h819283240H2021H217H3(H4145)
MFCD29709759
N(4(dimethylamino)phenyl)2((2(22dimethyl3(2methyl1Hindol3yl)cyclopropyl)acetyl)((4(trifluoromethyl)phenyl)methyl)amino)2methylpropanamide
N(4(dimethylamino)phenyl)N~2~((22dimethyl3(2methyl1Hindol3yl)cyclopropyl)acetyl)2methylN~2~(4(trifluoromethyl)benzyl)alaninamide
N(4DIMETHYLAMINOPHENYL)2((2(22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)ACETYL)((4(TRIFLUOROMETHYL)PHENYL)METHYL)AMINO)2METHYLPROPANAMIDE
O=C(N(C(C(=O)Nc1ccc(cc1)N(C)C)(C)C)Cc1ccc(cc1)C(F)(F)F)CC1C(C1(C)C)c1c(C)(nH)c2c1cccc2
ZINC000008696020
ZINC000101386417

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Available files

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