Vitas-M small molecule compound
9'-bromo-2'-(2-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Catalog ID
STK993448
SMILES Brc1ccc2c(c1)C1CC(=NN1C1(O2)CCN(CC1)C1CCCc2c1cccc2)c1ccccc1F
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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 C30H29BrFN3O MW 546.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29BrFN3O/c31-21-12-13-29-24(18-21)28-19-26(23-9-3-4-10-25(23)32)33-35(28)30(36-29)14-16-34(17-15-30)27-11-5-7-20-6-1-2-8-22(20)27/h1-4,6,8-10,12-13,18,27-28H,5,7,11,14-17,19H2InChIKey
ZMUUQGILHLYLIZ-UHFFFAOYSA-NSynonyms
877780-13-7877780137
9bromo2(2fluorophenyl)1(1234tetrahydronaphthalen1yl)110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine54piperidine)
9bromo2(2fluorophenyl)1(1234tetrahydronaphthalen1yl)110bdihydrospiro(piperidine45pyrazolo(15c)(13)benzoxazine)
9bromo2(2fluorophenyl)1(1234tetrahydronaphthalen1yl)spiro(110bdihydropyrazolo(15c)(13)benzoxazine54piperidine)
C1CC(C2=CC=CC=C2C1)N3CCC4(CC3)N5C(CC(=N5)C6=CC=CC=C6F)C7=C(O4)C=CC(=C7)Br
InChI=1SC30H29BrFN3Oc312112132924(1821)281926(239341025(23)32)3335(28)30(3629)141634(171530)27115720612822(20)27h1468101213182728H5711141719H2
MFCD05700205
ZINC000097955291
ZINC000245313072
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