Vitas-M small molecule compound

1-benzyl-9'-methyl-2'-(naphthalen-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]

Catalog ID
STK993473
SMILES Cc1ccc2c(c1)C1CC(=NN1C1(O2)CCN(CC1)Cc1ccccc1)c1ccc2c(c1)cccc2

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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 C32H31N3O MW 473.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31N3O/c1-23-11-14-31-28(19-23)30-21-29(27-13-12-25-9-5-6-10-26(25)20-27)33-35(30)32(36-31)15-17-34(18-16-32)22-24-7-3-2-4-8-24/h2-14,19-20,30H,15-18,21-22H2,1H3
InChIKey
QNXKAGMAAMFJAI-UHFFFAOYSA-N
Synonyms
848922-00-9
1benzyl9methyl2(naphthalen2yl)110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine54piperidine)
1benzyl9methyl2(naphthalen2yl)110bdihydrospiro(piperidine45pyrazolo(15c)(13)benzoxazine)
1BENZYL9METHYL2NAPHTHALEN2YLSPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE54PIPERIDINE)
848922009
CC1=CC2=C(C=C1)OC3(CCN(CC3)CC4=CC=CC=C4)N5C2CC(=N5)C6=CC7=CC=CC=C7C=C6
InChI=1SC32H31N3Oc12311143128(1923)302129(271312259561026(25)2027)3335(30)32(3631)151734(181632)22247324824h214192030H15182122H21H3
MFCD05677518
ZINC000009210718
ZINC000009210719

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.