Vitas-M small molecule compound
9-bromo-5-(4-butoxyphenyl)-2-(4-ethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STK739952
SMILES CCCCOc1ccc(cc1)C1Oc2ccc(cc2C2N1N=C(C2)c1ccc(cc1)OCC)Br
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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 C28H29BrN2O3 MW 521.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29BrN2O3/c1-3-5-16-33-23-13-8-20(9-14-23)28-31-26(24-17-21(29)10-15-27(24)34-28)18-25(30-31)19-6-11-22(12-7-19)32-4-2/h6-15,17,26,28H,3-5,16,18H2,1-2H3InChIKey
ITHMGWUNWALEAD-UHFFFAOYSA-NSynonyms
371116-67-51(2BROMO6(4BUTOXYPHENYL)(6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZIN9YL))4ETHOXYBENZENE
371116675
9bromo5(4butoxyphenyl)2(4ethoxyphenyl)110bdihydropyrazolo(15c)(13)benzoxazine
9bromo5(4butoxyphenyl)2(4ethoxyphenyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
9BROMO5(4BUTOXYPHENYL)2(4ETHOXYPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
CCCCOC1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC=C(C=C4)OCC)C5=C(O2)C=CC(=C5)Br
InChI=1SC28H29BrN2O3c13516332313820(91423)283126(241721(29)101527(24)3428)1825(3031)1961122(12719)3242h615172628H351618H212H3
MFCD03007534
ZINC000009066840
ZINC000012193432
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