Vitas-M small molecule compound
2-(5-{(1E)-3-[(3-bromophenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}furan-2-yl)benzoic acid
Catalog ID
STK186029
SMILES N#C/C(=C\c1ccc(o1)c1ccccc1C(=O)O)/C(=O)Nc1cccc(c1)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 C21H13BrN2O4 MW 437.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13BrN2O4/c22-14-4-3-5-15(11-14)24-20(25)13(12-23)10-16-8-9-19(28-16)17-6-1-2-7-18(17)21(26)27/h1-11H,(H,24,25)(H,26,27)/b13-10+InChIKey
MSMGBUUHYQRDHR-JLHYYAGUSA-NSynonyms
340305-36-42(5((1E)3((3BROMOPHENYL)AMINO)2CYANO3OXOPROP1EN1YL)FURAN2YL)BENZOICACID
2(5((E)3(3BROMOANILINO)2CYANO3OXOPROP1ENYL)FURAN2YL)BENZOICACID
340305364
C1=CC=C(C(=C1)C2=CC=C(O2)C=C(C#N)C(=O)NC3=CC(=CC=C3)Br)C(=O)O
InChI=1SC21H13BrN2O4c221443515(1114)2420(25)13(1223)10168919(2816)17612718(17)21(26)27h111H(H2425)(H2627)b1310+
MFCD02379143
N#CC(=Cc1ccc(o1)c1ccccc1C(=O)O)C(=O)Nc1cccc(c1)Br
ZINC000001082538
ZINC1082538
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