Vitas-M small molecule compound
5,7-dichloro-8-methoxy-6-[(1E)-3-(4-methoxyphenyl)-3-oxoprop-1-en-1-yl]-2H-1,4-benzoxazin-3(4H)-one
Catalog ID
STL434829
SMILES COc1ccc(cc1)C(=O)/C=C/c1c(Cl)c2NC(=O)COc2c(c1Cl)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 C19H15Cl2NO5 MW 408.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15Cl2NO5/c1-25-11-5-3-10(4-6-11)13(23)8-7-12-15(20)17-19(18(26-2)16(12)21)27-9-14(24)22-17/h3-8H,9H2,1-2H3,(H,22,24)/b8-7+InChIKey
MXBKBEXWQUUBAE-BQYQJAHWSA-NSynonyms
57dichloro8methoxy6((1E)3(4methoxyphenyl)3oxoprop1en1yl)2H14benzoxazin3(4H)one
57dichloro8methoxy6((E)3(4methoxyphenyl)3oxoprop1enyl)4H14benzoxazin3one
COC1=CC=C(C=C1)C(=O)C=CC2=C(C3=C(C(=C2Cl)OC)OCC(=O)N3)Cl
COc1ccc(cc1)C(=O)C=Cc1c(Cl)c2NC(=O)COc2c(c1Cl)OC
InChI=1SC19H15Cl2NO5c125115310(4611)13(23)871215(20)1719(18(262)16(12)21)27914(24)2217h38H9H212H3(H2224)b87+
MFCD30711446
ZINC000096336901
ZINC96336901
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