Vitas-M small molecule compound
(2E)-2-(1,3-benzoxazol-2-yl)-3-(4-nitrophenyl)-1-(4-propoxyphenyl)prop-2-en-1-one
Catalog ID
STK896817
SMILES CCCOc1ccc(cc1)C(=O)/C(=C/c1ccc(cc1)[N+](=O)[O-])/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 C25H20N2O5 MW 428.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O5/c1-2-15-31-20-13-9-18(10-14-20)24(28)21(16-17-7-11-19(12-8-17)27(29)30)25-26-22-5-3-4-6-23(22)32-25/h3-14,16H,2,15H2,1H3/b21-16-InChIKey
ABCRYPSTNJZXLR-PGMHBOJBSA-NSynonyms
(2E)2(13benzoxazol2yl)3(4nitrophenyl)1(4propoxyphenyl)prop2en1one
(2E)2BENZOXAZOL2YL3(4NITROPHENYL)1(4PROPOXYPHENYL)PROP2EN1ONE
(E)2(13BENZOXAZOL2YL)3(4NITROPHENYL)1(4PROPOXYPHENYL)PROP2EN1ONE
CCCOC1=CC=C(C=C1)C(=O)C(=CC2=CC=C(C=C2)(N+)(=O)(O))C3=NC4=CC=CC=C4O3
CCCOc1ccc(cc1)C(=O)C(=Cc1ccc(cc1)(N+)(=O)(O))c1nc2c(o1)cccc2
InChI=1SC25H20N2O5c1215312013918(101420)24(28)21(161771119(12817)27(29)30)252622534623(22)3225h31416H215H21H3b2116
MFCD03029191
ZINC000008779095
ZINC08779095
ZINC8779095
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