Vitas-M small molecule compound
5-(4-butoxyphenyl)-9-chloro-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STK739851
SMILES CCCCOc1ccc(cc1)C1Oc2ccc(cc2C2N1N=C(C2)c1ccc(cc1)C)Cl
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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 C27H27ClN2O2 MW 446.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27ClN2O2/c1-3-4-15-31-22-12-9-20(10-13-22)27-30-25(23-16-21(28)11-14-26(23)32-27)17-24(29-30)19-7-5-18(2)6-8-19/h5-14,16,25,27H,3-4,15,17H2,1-2H3InChIKey
JCOSWLKWFVQNSZ-UHFFFAOYSA-NSynonyms
4BUTOXY1(2CHLORO9(4METHYLPHENYL)(6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZIN6YL))BENZENE
5(4butoxyphenyl)9chloro2(4methylphenyl)110bdihydropyrazolo(15c)(13)benzoxazine
5(4BUTOXYPHENYL)9CHLORO2(4METHYLPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
5(4butoxyphenyl)9chloro2(ptolyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
CCCCOC1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC=C(C=C4)C)C5=C(O2)C=CC(=C5)Cl
InChI=1SC27H27ClN2O2c13415312212920(101322)273025(231621(28)111426(23)3227)1724(2930)197518(2)6819h514162527H341517H212H3
MFCD02987656
ZINC000009309931
ZINC000013799340
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