Vitas-M small molecule compound
N-[2-(1H-indol-3-yl)ethyl]-2'-(2-methoxyethyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Catalog ID
STL058745
SMILES COCCN1C(=O)c2ccccc2C(C21CCCC2)C(=O)NCCc1c[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 C27H31N3O3 MW 445.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3O3/c1-33-17-16-30-26(32)22-10-3-2-9-21(22)24(27(30)13-6-7-14-27)25(31)28-15-12-19-18-29-23-11-5-4-8-20(19)23/h2-5,8-11,18,24,29H,6-7,12-17H2,1H3,(H,28,31)InChIKey
CPHKSXYZLCNIDB-UHFFFAOYSA-NSynonyms
1212467-92-91212467929
COCCN1C(=O)C2=CC=CC=C2C(C13CCCC3)C(=O)NCCC4=CNC5=CC=CC=C54
COCCN1C(=O)c2ccccc2C(C21CCCC2)C(=O)NCCc1c(nH)c2c1cccc2
InChI=1SC27H31N3O3c13317163026(32)221032921(22)24(27(30)13671427)25(31)281512191829231154820(19)23h25811182429H671217H21H3(H2831)
MFCD18193051
N(2(1Hindol3yl)ethyl)2(2methoxyethyl)1oxo14dihydro2Hspiro(cyclopentane13isoquinoline)4carboxamide
N(2(1Hindol3yl)ethyl)2(2methoxyethyl)1oxo24dihydro1Hspiro(cyclopentane13isoquinoline)4carboxamide
N(2(1Hindol3yl)ethyl)2(2methoxyethyl)1oxospiro(4Hisoquinoline31cyclopentane)4carboxamide
ZINC000032073628
ZINC000032073629
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