Vitas-M small molecule compound

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

Catalog ID
STL246726
SMILES CCC(N1C(=O)c2ccccc2C(C21CCCCC2)C(=O)Nc1ncccc1C)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 C25H31N3O2 MW 405.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O2/c1-4-18(3)28-24(30)20-13-7-6-12-19(20)21(25(28)14-8-5-9-15-25)23(29)27-22-17(2)11-10-16-26-22/h6-7,10-13,16,18,21H,4-5,8-9,14-15H2,1-3H3,(H,26,27,29)
InChIKey
QGKYOVWVBVELJU-UHFFFAOYSA-N
Synonyms
1351670-80-8
1351670808
2(butan2yl)N(3methylpyridin2yl)1oxo14dihydro2Hspiro(cyclohexane13isoquinoline)4carboxamide
2(secbutyl)N(3methylpyridin2yl)1oxo24dihydro1Hspiro(cyclohexane13isoquinoline)4carboxamide
2butan2ylN(3methylpyridin2yl)1oxospiro(4Hisoquinoline31cyclohexane)4carboxamide
CCC(C)N1C(=O)C2=CC=CC=C2C(C13CCCCC3)C(=O)NC4=C(C=CC=N4)C
InChI=1SC25H31N3O2c1418(3)2824(30)2013761219(20)21(25(28)148591525)23(29)272217(2)1110162622h671013161821H45891415H213H3(H262729)
MFCD24860647
ZINC000072401625
ZINC000072401628

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Available files

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