Vitas-M small molecule compound
N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]-4-nitrobenzamide
Catalog ID
STK259607
SMILES S=C(Nc1c(C)cc(cc1C)Br)NC(=O)c1ccc(cc1)[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 C16H14BrN3O3S MW 408.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14BrN3O3S/c1-9-7-12(17)8-10(2)14(9)18-16(24)19-15(21)11-3-5-13(6-4-11)20(22)23/h3-8H,1-2H3,(H2,18,19,21,24)InChIKey
NKTZYYHZFOGORK-UHFFFAOYSA-NSynonyms
CC1=CC(=CC(=C1NC(=S)NC(=O)C2=CC=C(C=C2)(N+)(=O)(O))C)Br
InChI=1SC16H14BrN3O3Sc19712(17)810(2)14(9)1816(24)1915(21)113513(6411)20(22)23h38H12H3(H218192124)
MFCD02624937
N((4bromo26dimethylphenyl)carbamothioyl)4nitrobenzamide
S=C(Nc1c(C)cc(cc1C)Br)NC(=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000001180488
ZINC01180488
ZINC1180488
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