Vitas-M small molecule compound
5-(2-chloro-5-nitrophenyl)-2-(3,4-dimethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STL040712
SMILES COc1ccc(cc1OC)C1=NN2C(C1)c1ccccc1OC2c1cc(ccc1Cl)[N+](=O)[O-]
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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 C24H20ClN3O5 MW 465.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN3O5/c1-31-22-10-7-14(11-23(22)32-2)19-13-20-16-5-3-4-6-21(16)33-24(27(20)26-19)17-12-15(28(29)30)8-9-18(17)25/h3-12,20,24H,13H2,1-2H3InChIKey
GIZACVMZELPADB-UHFFFAOYSA-NSynonyms
714235-42-45(2chloro5nitrophenyl)2(34dimethoxyphenyl)110bdihydropyrazolo(15c)(13)benzoxazine
5(2chloro5nitrophenyl)2(34dimethoxyphenyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
5(2CHLORO5NITROPHENYL)2(34DIMETHOXYPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
714235424
COC1=C(C=C(C=C1)C2=NN3C(C2)C4=CC=CC=C4OC3C5=C(C=CC(=C5)(N+)(=O)(O))Cl)OC
COc1ccc(cc1OC)C1=NN2C(C1)c1ccccc1OC2c1cc(ccc1Cl)(N+)(=O)(O)
InChI=1SC24H20ClN3O5c1312210714(1123(22)322)19132016534621(16)3324(27(20)2619)171215(28(29)30)8918(17)25h3122024H13H212H3
MFCD04162664
ZINC000009359239
ZINC000245245718
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