Vitas-M small molecule compound
N-(2,4-dimethoxyphenyl)-4-[{[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]acetyl}(furan-2-ylmethyl)amino]-1-methylpiperidine-4-carboxamide
Catalog ID
STL439439
SMILES COc1cc(OC)ccc1NC(=O)C1(CCN(CC1)C)N(C(=O)CC1C(C1(C)C)c1c(C)[nH]c2c1cccc2)Cc1ccco1
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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 C36H44N4O5 MW 612.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H44N4O5/c1-23-32(26-11-7-8-12-28(26)37-23)33-27(35(33,2)3)21-31(41)40(22-25-10-9-19-45-25)36(15-17-39(4)18-16-36)34(42)38-29-14-13-24(43-5)20-30(29)44-6/h7-14,19-20,27,33,37H,15-18,21-22H2,1-6H3,(H,38,42)InChIKey
ROIRYERHUJQZFL-UHFFFAOYSA-NSynonyms
CC1=C(C2=CC=CC=C2N1)C3C(C3(C)C)CC(=O)N(CC4=CC=CO4)C5(CCN(CC5)C)C(=O)NC6=C(C=C(C=C6)OC)OC
COc1cc(OC)ccc1NC(=O)C1(CCN(CC1)C)N(C(=O)CC1C(C1(C)C)c1c(C)(nH)c2c1cccc2)Cc1ccco1
InChI=1SC36H44N4O5c12332(2611781228(26)3723)3327(35(332)3)2131(41)40(2225109194525)36(151739(4)181636)34(42)3829141324(435)2030(29)446h7141920273337H15182122H216H3(H3842)
MFCD29709824
N(24dimethoxyphenyl)4(((22dimethyl3(2methyl1Hindol3yl)cyclopropyl)acetyl)(furan2ylmethyl)amino)1methylpiperidine4carboxamide
N(24DIMETHOXYPHENYL)4((2(22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)ACETYL)(FURAN2YLMETHYL)AMINO)1METHYLPIPERIDINE4CARBOXAMIDE
N(24DIMETHOXYPHENYL)4(2((1R3S)22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)N(FURAN2YLMETHYL)ACETAMIDO)1METHYLPIPERIDINE4CARBOXAMIDE
ZINC000008749476
ZINC000101386112
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