Vitas-M small molecule compound

N-(2,4-dimethoxyphenyl)-1-({[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]acetyl}[4-(trifluoromethyl)benzyl]amino)cyclopentanecarboxamide

Catalog ID
STL439383
SMILES COc1cc(OC)ccc1NC(=O)C1(CCCC1)N(C(=O)CC1C(C1(C)C)c1c(C)[nH]c2c1cccc2)Cc1ccc(cc1)C(F)(F)F

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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 C38H42F3N3O4 MW 661.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H42F3N3O4/c1-23-33(27-10-6-7-11-29(27)42-23)34-28(36(34,2)3)21-32(45)44(22-24-12-14-25(15-13-24)38(39,40)41)37(18-8-9-19-37)35(46)43-30-17-16-26(47-4)20-31(30)48-5/h6-7,10-17,20,28,34,42H,8-9,18-19,21-22H2,1-5H3,(H,43,46)
InChIKey
VUEOBZVTCKETPO-UHFFFAOYSA-N
Synonyms

CC1=C(C2=CC=CC=C2N1)C3C(C3(C)C)CC(=O)N(CC4=CC=C(C=C4)C(F)(F)F)C5(CCCC5)C(=O)NC6=C(C=C(C=C6)OC)OC
COc1cc(OC)ccc1NC(=O)C1(CCCC1)N(C(=O)CC1C(C1(C)C)c1c(C)(nH)c2c1cccc2)Cc1ccc(cc1)C(F)(F)F
InChI=1SC38H42F3N3O4c12333(2710671129(27)4223)3428(36(342)3)2132(45)44(2224121425(151324)38(3940)41)37(18891937)35(46)4330171626(474)2031(30)485h67101720283442H8918192122H215H3(H4346)
MFCD29709776
N(24dimethoxyphenyl)1(((22dimethyl3(2methyl1Hindol3yl)cyclopropyl)acetyl)(4(trifluoromethyl)benzyl)amino)cyclopentanecarboxamide
N(24DIMETHOXYPHENYL)1((2(22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)ACETYL)((4(TRIFLUOROMETHYL)PHENYL)METHYL)AMINO)CYCLOPENTANE1CARBOXAMIDE
N(24DIMETHOXYPHENYL)1(2((1R3S)22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)N(4(TRIFLUOROMETHYL)BENZYL)ACETAMIDO)CYCLOPENTANECARBOXAMIDE
ZINC000150346592
ZINC000150600339

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Available files

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