Vitas-M small molecule compound
4-bromo-N-{3-[(4-methylphenyl)carbamoyl]phenyl}-3-nitrobenzamide
Catalog ID
STK247312
SMILES Cc1ccc(cc1)NC(=O)c1cccc(c1)NC(=O)c1ccc(c(c1)[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 C21H16BrN3O4 MW 454.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrN3O4/c1-13-5-8-16(9-6-13)23-20(26)14-3-2-4-17(11-14)24-21(27)15-7-10-18(22)19(12-15)25(28)29/h2-12H,1H3,(H,23,26)(H,24,27)InChIKey
DDWXPZXOUORDFE-UHFFFAOYSA-NSynonyms
4BROMON(3((4METHYLPHENYL)CARBAMOYL)PHENYL)3NITROBENZAMIDE
CC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)NC(=O)C3=CC(=C(C=C3)Br)(N+)(=O)(O)
Cc1ccc(cc1)NC(=O)c1cccc(c1)NC(=O)c1ccc(c(c1)(N+)(=O)(O))Br
InChI=1SC21H16BrN3O4c1135816(9613)2320(26)1432417(1114)2421(27)1571018(22)19(1215)25(28)29h212H1H3(H2326)(H2427)
MFCD00761538
ZINC000000990257
ZINC00990257
ZINC990257
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