Vitas-M small molecule compound
N-{(1E)-3-[(2E)-2-(4-bromo-3-nitrobenzylidene)hydrazinyl]-1-[4-(diethylamino)phenyl]-3-oxoprop-1-en-2-yl}benzamide
Catalog ID
STL171888
SMILES CCN(c1ccc(cc1)/C=C(\C(=O)N/N=C/c1ccc(c(c1)[N+](=O)[O-])Br)/NC(=O)c1ccccc1)CC
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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 C27H26BrN5O4 MW 564.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26BrN5O4/c1-3-32(4-2)22-13-10-19(11-14-22)16-24(30-26(34)21-8-6-5-7-9-21)27(35)31-29-18-20-12-15-23(28)25(17-20)33(36)37/h5-18H,3-4H2,1-2H3,(H,30,34)(H,31,35)/b24-16+,29-18+InChIKey
INPLUNUPIFVKPZ-SWOOFCMFSA-NSynonyms
CCN(c1ccc(cc1)C=C(C(=O)NN=Cc1ccc(c(c1)(N+)(=O)(O))Br)NC(=O)c1ccccc1)CC
CCN(CC)C1=CC=C(C=C1)C=C(C(=O)NN=CC2=CC(=C(C=C2)Br)(N+)(=O)(O))NC(=O)C3=CC=CC=C3
InChI=1SC27H26BrN5O4c1332(42)22131019(111422)1624(3026(34)218657921)27(35)31291820121523(28)25(1720)33(36)37h518H34H212H3(H3034)(H3135)b2416+2918+
MFCD01147055
N((1E)3((2E)2(4bromo3nitrobenzylidene)hydrazinyl)1(4(diethylamino)phenyl)3oxoprop1en2yl)benzamide
N((E)3((2E)2((4bromo3nitrophenyl)methylidene)hydrazinyl)1(4(diethylamino)phenyl)3oxoprop1en2yl)benzamide
N(1((2(4BROMO3NITROBENZYLIDENE)HYDRAZINO)CARBONYL)2(4(DIETHYLAMINO)PHENYL)VINYL)BENZAMIDE
ZINC000103249335
ZINC103249328
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