Vitas-M small molecule compound

9-bromo-5-(3-nitrophenyl)-2-(thiophen-2-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine

Catalog ID
STK740262
SMILES Brc1ccc2c(c1)C1CC(=NN1C(O2)c1cccc(c1)[N+](=O)[O-])c1cccs1

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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 C20H14BrN3O3S MW 456.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14BrN3O3S/c21-13-6-7-18-15(10-13)17-11-16(19-5-2-8-28-19)22-23(17)20(27-18)12-3-1-4-14(9-12)24(25)26/h1-10,17,20H,11H2
InChIKey
WHJXGTMGKLRQCC-UHFFFAOYSA-N
Synonyms
332063-19-1
2(2BROMO6(3NITROPHENYL)6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZIN9YL)THIOPHENE
332063191
9bromo5(3nitrophenyl)2(thiophen2yl)110bdihydropyrazolo(15c)(13)benzoxazine
9bromo5(3nitrophenyl)2(thiophen2yl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
9BROMO5(3NITROPHENYL)2THIEN2YL110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE
9BROMO5(3NITROPHENYL)2THIOPHEN2YL510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
Brc1ccc2c(c1)C1CC(=NN1C(O2)c1cccc(c1)(N+)(=O)(O))c1cccs1
C1C2C3=C(C=CC(=C3)Br)OC(N2N=C1C4=CC=CS4)C5=CC(=CC=C5)(N+)(=O)(O)
InChI=1SC20H14BrN3O3Sc2113671815(1013)171116(195282819)2223(17)20(2718)1231414(912)24(25)26h1101720H11H2
MFCD01542797
ZINC000008439916
ZINC000012194900

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Available files

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