Vitas-M small molecule compound
3-(5-{(1E)-3-[(3-bromophenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}furan-2-yl)benzoic acid
Catalog ID
STK007181
SMILES N#C/C(=C\c1ccc(o1)c1cccc(c1)C(=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/c22-16-5-2-6-17(11-16)24-20(25)15(12-23)10-18-7-8-19(28-18)13-3-1-4-14(9-13)21(26)27/h1-11H,(H,24,25)(H,26,27)/b15-10+InChIKey
ZMCKRMWNHDPLSY-XNTDXEJSSA-NSynonyms
359768-19-73(5((1E)2(N(3BROMOPHENYL)CARBAMOYL)2CYANOVINYL)2FURYL)BENZOICACID
3(5((1E)3((3BROMOPHENYL)AMINO)2CYANO3OXOPROP1EN1YL)FURAN2YL)BENZOICACID
3(5((E)3(3BROMOANILINO)2CYANO3OXOPROP1ENYL)FURAN2YL)BENZOICACID
359768197
C1=CC(=CC(=C1)C(=O)O)C2=CC=C(O2)C=C(C#N)C(=O)NC3=CC(=CC=C3)Br
InChI=1SC21H13BrN2O4c221652617(1116)2420(25)15(1223)10187819(2818)1331414(913)21(26)27h111H(H2425)(H2627)b1510+
MFCD02611941
N#CC(=Cc1ccc(o1)c1cccc(c1)C(=O)O)C(=O)Nc1cccc(c1)Br
STK007181
ZINC000002805952
ZINC2805952
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