Vitas-M small molecule compound

2'-butyl-1'-oxo-N-(pyridin-4-ylmethyl)-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide

Catalog ID
STL158602
SMILES CCCCN1C(=O)c2ccccc2C(C21CCCCC2)C(=O)NCc1ccncc1

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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/c1-2-3-17-28-24(30)21-10-6-5-9-20(21)22(25(28)13-7-4-8-14-25)23(29)27-18-19-11-15-26-16-12-19/h5-6,9-12,15-16,22H,2-4,7-8,13-14,17-18H2,1H3,(H,27,29)
InChIKey
GOBHCJHLCSXHKA-UHFFFAOYSA-N
Synonyms
1323955-18-5
1323955185
2butyl1oxoN(pyridin4ylmethyl)14dihydro2Hspiro(cyclohexane13isoquinoline)4carboxamide
2butyl1oxoN(pyridin4ylmethyl)24dihydro1Hspiro(cyclohexane13isoquinoline)4carboxamide
2butyl1oxoN(pyridin4ylmethyl)spiro(4Hisoquinoline31cyclohexane)4carboxamide
CCCCN1C(=O)C2=CC=CC=C2C(C13CCCCC3)C(=O)NCC4=CC=NC=C4
InChI=1SC25H31N3O2c123172824(30)211065920(21)22(25(28)137481425)23(29)271819111526161219h56912151622H247813141718H21H3(H2729)
MFCD20758398
ZINC000071282581
ZINC000071282582

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Available files

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