Vitas-M small molecule compound
(3Z)-3-(1H-benzimidazol-2-yl)-4-(4-bromophenyl)but-3-enoic acid
Catalog ID
STL175224
SMILES Brc1ccc(cc1)/C=C(\c1nc2c([nH]1)cccc2)/CC(=O)O
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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 C17H13BrN2O2 MW 357.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13BrN2O2/c18-13-7-5-11(6-8-13)9-12(10-16(21)22)17-19-14-3-1-2-4-15(14)20-17/h1-9H,10H2,(H,19,20)(H,21,22)/b12-9-InChIKey
JRLYJZRWIKEQPA-XFXZXTDPSA-NSynonyms
932178-87-5(3Z)3(1Hbenzimidazol2yl)4(4bromophenyl)but3enoicacid
(3Z)3BENZIMIDAZOL2YL4(4BROMOPHENYL)BUT3ENOICACID
(Z)3(1Hbenzimidazol2yl)4(4bromophenyl)but3enoicacid
932178875
Brc1ccc(cc1)C=C(c1nc2c((nH)1)cccc2)CC(=O)O
C1=CC=C2C(=C1)NC(=N2)C(=CC3=CC=C(C=C3)Br)CC(=O)O
InChI=1SC17H13BrN2O2c18137511(6813)912(1016(21)22)171914312415(14)2017h19H10H2(H1920)(H2122)b129
MFCD08558542
ZINC000013640660
ZINC13640660
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