Vitas-M small molecule compound

N-(butan-2-yl)-2'-(2-methoxyethyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide

Catalog ID
STL469496
SMILES COCCN1C(=O)c2ccccc2C(C21CCCCC2)C(=O)NC(CC)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 C22H32N2O3 MW 372.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H32N2O3/c1-4-16(2)23-20(25)19-17-10-6-7-11-18(17)21(26)24(14-15-27-3)22(19)12-8-5-9-13-22/h6-7,10-11,16,19H,4-5,8-9,12-15H2,1-3H3,(H,23,25)
InChIKey
IOVJXNZIFLYSNT-UHFFFAOYSA-N
Synonyms
1246038-96-9
1246038969
CCC(C)NC(=O)C1C2=CC=CC=C2C(=O)N(C13CCCCC3)CCOC
InChI=1SC22H32N2O3c1416(2)2320(25)191710671118(17)21(26)24(1415273)22(19)128591322h6710111619H45891215H213H3(H2325)
MFCD20503835
N(butan2yl)2(2methoxyethyl)1oxo14dihydro2Hspiro(cyclohexane13isoquinoline)4carboxamide
N(secbutyl)2(2methoxyethyl)1oxo24dihydro1Hspiro(cyclohexane13isoquinoline)4carboxamide
Nbutan2yl2(2methoxyethyl)1oxospiro(4Hisoquinoline31cyclohexane)4carboxamide
ZINC000049543780
ZINC000049543786

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Available files

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