Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-N-(furan-2-ylmethyl)-N-{1-(4-methoxyphenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl}prop-2-enamide
Catalog ID
STK149230
SMILES COc1ccc(cc1)C(N(C(=O)/C=C/c1ccc2c(c1)OCO2)Cc1ccco1)C(=O)Nc1ccc(cc1)OC
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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 C31H28N2O7 MW 540.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N2O7/c1-36-24-11-7-22(8-12-24)30(31(35)32-23-9-13-25(37-2)14-10-23)33(19-26-4-3-17-38-26)29(34)16-6-21-5-15-27-28(18-21)40-20-39-27/h3-18,30H,19-20H2,1-2H3,(H,32,35)/b16-6+InChIKey
MXCYWRZEYXMTSC-OMCISZLKSA-NSynonyms
(2E)3(13BENZODIOXOL5YL)N(FURAN2YLMETHYL)N(1(4METHOXYPHENYL)2((4METHOXYPHENYL)AMINO)2OXOETHYL)PROP2ENAMIDE
(E)3(13BENZODIOXOL5YL)N(FURAN2YLMETHYL)N(2(4METHOXYANILINO)1(4METHOXYPHENYL)2OXOETHYL)PROP2ENAMIDE
COC1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)OC)N(CC3=CC=CO3)C(=O)C=CC4=CC5=C(C=C4)OCO5
COc1ccc(cc1)C(N(C(=O)C=Cc1ccc2c(c1)OCO2)Cc1ccco1)C(=O)Nc1ccc(cc1)OC
InChI=1SC31H28N2O7c1362411722(81224)30(31(35)322391325(372)141023)33(192643173826)29(34)166215152728(1821)40203927h31830H1920H212H3(H3235)b166+
MFCD03449814
ZINC000003615429
ZINC000003615436
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