Vitas-M small molecule compound
(3E)-3-({1-[2-(azepan-1-yl)-2-oxoethyl]-1H-indol-3-yl}methylidene)-1-methyl-1,3-dihydro-2H-indol-2-one
Catalog ID
STK709739
SMILES O=C(N1CCCCCC1)Cn1cc(c2c1cccc2)/C=C/1\c2ccccc2N(C1=O)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 C26H27N3O2 MW 413.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O2/c1-27-23-12-6-5-11-21(23)22(26(27)31)16-19-17-29(24-13-7-4-10-20(19)24)18-25(30)28-14-8-2-3-9-15-28/h4-7,10-13,16-17H,2-3,8-9,14-15,18H2,1H3/b22-16+InChIKey
YLIBTSIADATCFP-CJLVFECKSA-NSynonyms
(3E)3((1(2(azepan1yl)2oxoethyl)1Hindol3yl)methylidene)1methyl13dihydro2Hindol2one
(3E)3((1(2(AZEPAN1YL)2OXOETHYL)INDOL3YL)METHYLIDENE)1METHYLINDOL2ONE
CN1C2=CC=CC=C2C(=CC3=CN(C4=CC=CC=C43)CC(=O)N5CCCCCC5)C1=O
InChI=1SC26H27N3O2c1272312651121(23)22(26(27)31)16191729(2413741020(19)24)1825(30)281482391528h4710131617H2389141518H21H3b2216+
MFCD04333401
O=C(N1CCCCCC1)Cn1cc(c2c1cccc2)C=C1c2ccccc2N(C1=O)C
ZINC000004516938
ZINC04516938
ZINC4516938
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