Vitas-M small molecule compound
2-(1-benzyl-2-methyl-1H-indol-3-yl)-5,7-diethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Catalog ID
STK685091
SMILES CCC12CN3CC(C2=O)(CN(C1)C3c1c(C)n(c2c1cccc2)Cc1ccccc1)CC
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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 C28H33N3O MW 427.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33N3O/c1-4-27-16-29-18-28(5-2,26(27)32)19-30(17-27)25(29)24-20(3)31(15-21-11-7-6-8-12-21)23-14-10-9-13-22(23)24/h6-14,25H,4-5,15-19H2,1-3H3InChIKey
PBOCFORCZLHBKW-UHFFFAOYSA-NSynonyms
2(1benzyl2methyl1Hindol3yl)57diethyl13diazatricyclo(3311~37~)decan6one
CCC12CN3CC(C1=O)(CN(C2)C3C4=C(N(C5=CC=CC=C54)CC6=CC=CC=C6)C)CC
InChI=1SC28H33N3Oc142716291828(5226(27)32)1930(1727)25(29)2420(3)31(1521117681221)23141091322(23)24h61425H451519H213H3
MFCD05857181
ZINC000019325108
ZINC19325108
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