Vitas-M small molecule compound
5-bromo-2-methoxy-N-[(2-methyl-4-nitrophenyl)carbamothioyl]benzamide
Catalog ID
STK005599
SMILES COc1ccc(cc1C(=O)NC(=S)Nc1ccc(cc1C)[N+](=O)[O-])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 C16H14BrN3O4S MW 424.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14BrN3O4S/c1-9-7-11(20(22)23)4-5-13(9)18-16(25)19-15(21)12-8-10(17)3-6-14(12)24-2/h3-8H,1-2H3,(H2,18,19,21,25)InChIKey
AKBMNYVQPREPFD-UHFFFAOYSA-NSynonyms
5BROMO2METHOXYN((2METHYL4NITROPHENYL)CARBAMOTHIOYL)BENZAMIDE
CC1=C(C=CC(=C1)(N+)(=O)(O))NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OC
COc1ccc(cc1C(=O)NC(=S)Nc1ccc(cc1C)(N+)(=O)(O))Br
InChI=1SC16H14BrN3O4Sc19711(20(22)23)4513(9)1816(25)1915(21)12810(17)3614(12)242h38H12H3(H218192125)
MFCD03030913
STK005599
ZINC000008916700
ZINC08916700
ZINC8916700
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