Vitas-M small molecule compound
(2Z)-N-(3-bromo-4-methoxybenzyl)-2-(3-nitrobenzylidene)hydrazinecarbothioamide
Catalog ID
STK380110
SMILES COc1ccc(cc1Br)CNC(=S)N/N=C\c1cccc(c1)[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 C16H15BrN4O3S MW 423.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15BrN4O3S/c1-24-15-6-5-12(8-14(15)17)9-18-16(25)20-19-10-11-3-2-4-13(7-11)21(22)23/h2-8,10H,9H2,1H3,(H2,18,20,25)/b19-10-InChIKey
LFQAJJRRDVXHPP-GRSHGNNSSA-NSynonyms
(2Z)N(3bromo4methoxybenzyl)2(3nitrobenzylidene)hydrazinecarbothioamide
1((3BROMO4METHOXYPHENYL)METHYL)3((Z)(3NITROPHENYL)METHYLIDENEAMINO)THIOUREA
COC1=C(C=C(C=C1)CNC(=S)NN=CC2=CC(=CC=C2)(N+)(=O)(O))Br
COc1ccc(cc1Br)CNC(=S)NN=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC16H15BrN4O3Sc124156512(814(15)17)91816(25)2019101132413(711)21(22)23h2810H9H21H3(H2182025)b1910
MFCD00571381
ZINC000030738643
ZINC03187145
ZINC3187145
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