Vitas-M small molecule compound

7,9-dibromo-5-(4-methylphenyl)-2-(thiophen-2-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine

Catalog ID
STK740217
SMILES Cc1ccc(cc1)C1Oc2c(Br)cc(cc2C2N1N=C(C2)c1cccs1)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 C21H16Br2N2OS MW 504.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16Br2N2OS/c1-12-4-6-13(7-5-12)21-25-18(11-17(24-25)19-3-2-8-27-19)15-9-14(22)10-16(23)20(15)26-21/h2-10,18,21H,11H2,1H3
InChIKey
NESUHXJMCDZHCF-UHFFFAOYSA-N
Synonyms
671763-62-5
2(24DIBROMO6(4METHYLPHENYL)6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZIN9YL)THIOPHENE
671763625
79dibromo2(thiophen2yl)5(ptolyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
79dibromo5(4methylphenyl)2(thiophen2yl)110bdihydropyrazolo(15c)(13)benzoxazine
79DIBROMO5(4METHYLPHENYL)2THIOPHEN2YL510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
CC1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC=CS4)C5=CC(=CC(=C5O2)Br)Br
InChI=1SC21H16Br2N2OSc1124613(7512)212518(1117(2425)193282719)15914(22)1016(23)20(15)2621h2101821H11H21H3
MFCD03089155
ZINC000008817560
ZINC000012195578

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Available files

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