Vitas-M small molecule compound
2'-(2-methylpropyl)-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
Catalog ID
STL539468
SMILES CC(CN1C(=O)c2ccccc2C(C21CCCCC2)C(=O)NC[C@@H]1CCCN2[C@@H]1CCCC2)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 C29H43N3O2 MW 465.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H43N3O2/c1-21(2)20-32-28(34)24-13-5-4-12-23(24)26(29(32)15-7-3-8-16-29)27(33)30-19-22-11-10-18-31-17-9-6-14-25(22)31/h4-5,12-13,21-22,25-26H,3,6-11,14-20H2,1-2H3,(H,30,33)/t22-,25+,26?/m0/s1InChIKey
QYOCZGINUVALFF-OTRRWNHKSA-NSynonyms
1435868-66-8~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)2(2methylpropyl)1oxospiro(4~(H)isoquinoline31cyclohexane)4carboxamide
1435868668
2(2methylpropyl)N((1S9aR)octahydro2Hquinolizin1ylmethyl)1oxo14dihydro2Hspiro(cyclohexane13isoquinoline)4carboxamide
2isobutylN(((1S9aR)octahydro1Hquinolizin1yl)methyl)1oxo24dihydro1Hspiro(cyclohexane13isoquinoline)4carboxamide
71754895
CC(CN1C(=O)c2ccccc2C(C21CCCCC2)C(=O)NC(C@@H)1CCCN2(C@@H)1CCCC2)C
InChI=1SC29H43N3O2c121(2)203228(34)2413541223(24)26(29(32)157381629)27(33)3019221110183117961425(22)31h45121321222526H36111420H212H3(H3033)t2225+26?m0s1
ZINC000085877440
ZINC000085877448
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