Vitas-M small molecule compound
9-chloro-2-(5-methylfuran-2-yl)-5-(3-nitrophenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STK740253
SMILES Clc1ccc2c(c1)C1CC(=NN1C(O2)c1cccc(c1)[N+](=O)[O-])c1ccc(o1)C
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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 C21H16ClN3O4 MW 409.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN3O4/c1-12-5-7-20(28-12)17-11-18-16-10-14(22)6-8-19(16)29-21(24(18)23-17)13-3-2-4-15(9-13)25(26)27/h2-10,18,21H,11H2,1H3InChIKey
LCOFVFSEVLSQHY-UHFFFAOYSA-NSynonyms
577997-95-62CHLORO9(5METHYL(2FURYL))6(3NITROPHENYL)6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZINE
577997956
9chloro2(5methylfuran2yl)5(3nitrophenyl)110bdihydropyrazolo(15c)(13)benzoxazine
9chloro2(5methylfuran2yl)5(3nitrophenyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
9CHLORO2(5METHYLFURAN2YL)5(3NITROPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
CC1=CC=C(O1)C2=NN3C(C2)C4=C(C=CC(=C4)Cl)OC3C5=CC(=CC=C5)(N+)(=O)(O)
Clc1ccc2c(c1)C1CC(=NN1C(O2)c1cccc(c1)(N+)(=O)(O))c1ccc(o1)C
InChI=1SC21H16ClN3O4c1125720(2812)171118161014(22)6819(16)2921(24(18)2317)1332415(913)25(26)27h2101821H11H21H3
MFCD04022664
ZINC000005071793
ZINC000036352204
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