Vitas-M small molecule compound
1-benzyl-9'-bromo-2'-(4-methoxyphenyl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Catalog ID
STK740801
SMILES COc1ccc(cc1)C1=NN2C(C1)c1cc(Br)ccc1OC12CCN(CC1)Cc1ccccc1
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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 C28H28BrN3O2 MW 518.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28BrN3O2/c1-33-23-10-7-21(8-11-23)25-18-26-24-17-22(29)9-12-27(24)34-28(32(26)30-25)13-15-31(16-14-28)19-20-5-3-2-4-6-20/h2-12,17,26H,13-16,18-19H2,1H3InChIKey
YWMOMAQSONHXLU-UHFFFAOYSA-NSynonyms
487036-71-51(2BROMO14BENZYLSPIRO(10AHBENZO(E)2PYRAZOLINO(15C)13OXAZINE64PIPERIDINE)9YL)4METHOXYBENZENE
1benzyl9bromo2(4methoxyphenyl)110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine54piperidine)
1benzyl9bromo2(4methoxyphenyl)110bdihydrospiro(piperidine45pyrazolo(15c)(13)benzoxazine)
1BENZYL9BROMO2(4METHOXYPHENYL)SPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE54PIPERIDINE)
487036715
COC1=CC=C(C=C1)C2=NN3C(C2)C4=C(C=CC(=C4)Br)OC35CCN(CC5)CC6=CC=CC=C6
InChI=1SC28H28BrN3O2c1332310721(81123)251826241722(29)91227(24)3428(32(26)3025)131531(161428)19205324620h2121726H13161819H21H3
MFCD03287321
ZINC000008717727
ZINC000008717728
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