Vitas-M small molecule compound
N-(1-{[2-(1H-benzimidazol-2-yl)ethyl]amino}-3-methyl-1-oxobut-2-en-2-yl)-2-bromobenzamide
Catalog ID
STL342634
SMILES CC(=C(C(=O)NCCc1nc2c([nH]1)cccc2)NC(=O)c1ccccc1Br)C
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We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H21BrN4O2 MW 441.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrN4O2/c1-13(2)19(26-20(27)14-7-3-4-8-15(14)22)21(28)23-12-11-18-24-16-9-5-6-10-17(16)25-18/h3-10H,11-12H2,1-2H3,(H,23,28)(H,24,25)(H,26,27)InChIKey
SWPVRBRZVOJDEO-UHFFFAOYSA-NSynonyms
844452-54-6844452546
CC(=C(C(=O)NCCC1=NC2=CC=CC=C2N1)NC(=O)C3=CC=CC=C3Br)C
CC(=C(C(=O)NCCc1nc2c((nH)1)cccc2)NC(=O)c1ccccc1Br)C
InChI=1SC21H21BrN4O2c113(2)19(2620(27)14734815(14)22)21(28)2312111824169561017(16)2518h310H1112H212H3(H2328)(H2425)(H2627)
MFCD04157283
N(1((2(1Hbenzimidazol2yl)ethyl)amino)3methyl1oxobut2en2yl)2bromobenzamide
N(1((2(1Hbenzo(d)imidazol2yl)ethyl)amino)3methyl1oxobut2en2yl)2bromobenzamide
N(1(2(1HBENZIMIDAZOL2YL)ETHYLAMINO)3METHYL1OXOBUT2EN2YL)2BROMOBENZAMIDE
N(1(2(1HBENZOIMIDAZOL2YL)ETHYLCARBAMOYL)2METHYLPROPENYL)2BROMOBENZAMIDE
ZINC000038151013
ZINC38151013
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