Vitas-M small molecule compound
2-(7-bromo-2-oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)-N'-[(E)-(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]acetohydrazide
Catalog ID
STL402744
SMILES O=C(CN1C(=O)CN=C(c2c1ccc(c2)Br)c1ccccc1)N/N=C/c1cnn(c1C)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 C23H21BrN6O2 MW 493.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrN6O2/c1-15-17(12-27-29(15)2)11-26-28-21(31)14-30-20-9-8-18(24)10-19(20)23(25-13-22(30)32)16-6-4-3-5-7-16/h3-12H,13-14H2,1-2H3,(H,28,31)/b26-11+InChIKey
LOUBJDNQQRBYHW-KBKYJPHKSA-NSynonyms
1006326-18-61006326186
2(7bromo2oxo5phenyl23dihydro1H14benzodiazepin1yl)N((E)(15dimethyl1Hpyrazol4yl)methylidene)acetohydrazide
2(7bromo2oxo5phenyl3H14benzodiazepin1yl)N((E)(15dimethylpyrazol4yl)methylideneamino)acetamide
CC1=C(C=NN1C)C=NNC(=O)CN2C(=O)CN=C(C3=C2C=CC(=C3)Br)C4=CC=CC=C4
InChI=1SC23H21BrN6O2c11517(122729(15)2)11262821(31)1430209818(24)1019(20)23(251322(30)32)166435716h312H1314H212H3(H2831)b2611+
MFCD08557464
O=C(CN1C(=O)CN=C(c2c1ccc(c2)Br)c1ccccc1)NN=Cc1cnn(c1C)C
ZINC000020606688
ZINC101570601
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