Vitas-M small molecule compound
(2E)-2-(1,3-benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-[5-(2,4-dichlorophenyl)furan-2-yl]prop-2-en-1-one
Catalog ID
STK982731
SMILES CCCCOc1ccc(cc1)C(=O)/C(=C/c1ccc(o1)c1ccc(cc1Cl)Cl)/c1nc2c(o1)cccc2
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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 C30H23Cl2NO4 MW 532.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23Cl2NO4/c1-2-3-16-35-21-11-8-19(9-12-21)29(34)24(30-33-26-6-4-5-7-28(26)37-30)18-22-13-15-27(36-22)23-14-10-20(31)17-25(23)32/h4-15,17-18H,2-3,16H2,1H3/b24-18-InChIKey
FTQQXGCJBLIHRH-MOHJPFBDSA-NSynonyms
(2E)2(13benzoxazol2yl)1(4butoxyphenyl)3(5(24dichlorophenyl)furan2yl)prop2en1one
(2E)2BENZOXAZOL2YL3(5(24DICHLOROPHENYL)(2FURYL))1(4BUTOXYPHENYL)PROP2EN1ONE
(E)2(13BENZOXAZOL2YL)1(4BUTOXYPHENYL)3(5(24DICHLOROPHENYL)FURAN2YL)PROP2EN1ONE
CCCCOC1=CC=C(C=C1)C(=O)C(=CC2=CC=C(O2)C3=C(C=C(C=C3)Cl)Cl)C4=NC5=CC=CC=C5O4
CCCCOc1ccc(cc1)C(=O)C(=Cc1ccc(o1)c1ccc(cc1Cl)Cl)c1nc2c(o1)cccc2
InChI=1SC30H23Cl2NO4c12316352111819(91221)29(34)24(303326645728(26)3730)1822131527(3622)23141020(31)1725(23)32h4151718H2316H21H3b2418
MFCD03650946
ZINC000097947633
ZINC97947633
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